NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4176 8.3049 120.3672 54.6002 34.2715 175.1899 2 I 4.5386 7.8246 118.1904 59.2466 40.0874 174.2140 3 F 5.2364 8.4990 119.5728 57.0556 42.6927 173.9944 4 S 4.8135 7.9638 111.3158 57.3652 64.5864 174.8508 5 V 4.2837 7.9657 118.9429 61.2910 32.3156 172.2949 6 R 4.4881 8.3243 124.6025 55.5107 30.8847 175.1076 7 G 3.9805 8.8753 114.7197 46.3412 0.0000 171.2999 8 E 5.0450 8.2034 123.0373 54.2187 32.2352 176.3851 9 V 3.8210 8.9561 128.3004 63.5247 31.9218 175.0459 10 L 4.3563 9.0621 131.1322 54.9078 40.9417 176.6060 11 E 4.4832 8.1028 119.6713 55.2060 32.7698 175.4397 12 V 4.5307 8.1498 122.9635 60.4003 31.8365 177.0000 13 A 4.3073 8.1298 125.6399 51.6356 18.5002 176.9200 14 L 4.1533 8.1683 113.2991 57.6485 41.8144 177.7560 15 D 4.5618 7.1501 118.4691 55.3410 39.8790 175.1123 16 H 4.4394 8.0072 115.3708 55.9210 30.5089 173.5751 17 A 4.8272 8.0423 117.4192 50.9442 23.0924 175.4495 18 V 4.8803 9.3178 119.9634 61.1666 35.4631 174.5207 19 I 4.9751 8.3900 126.2269 59.6392 41.4806 174.3552 20 E 4.7923 9.0126 128.2567 55.0922 29.7577 174.5377 21 A 4.3601 9.4746 129.4125 51.3481 18.1433 176.4297 22 A 3.5355 9.6219 116.8167 53.3406 15.8869 176.1400 23 G 3.9519 8.3399 115.2011 44.5347 0.0000 172.2619 24 I 3.7259 8.2740 117.4563 61.0269 39.4483 175.8489 25 G 4.3135 8.1365 111.0211 44.8254 0.0000 171.6216 26 Y 4.6237 9.1965 123.7525 56.3479 40.2049 174.9409 27 R 4.2785 8.5617 124.8030 56.0917 30.3069 176.2650 28 V 4.3031 8.5964 127.1831 59.9679 32.4727 173.1437 29 N 4.3996 7.9850 121.7462 54.1075 39.8029 173.9270 30 A 4.3048 7.7015 121.4900 51.7813 22.6699 175.1644 31 T 4.6171 7.4545 105.2686 58.6528 71.8497 172.7945 32 P 4.1395 0.0000 0.0000 66.8214 30.7060 178.3414 33 S 4.1327 7.5228 113.8204 60.8679 62.9813 176.0856 34 A 4.3374 8.6513 123.0588 53.9297 18.9436 179.0976 35 L 3.8317 7.9062 116.6910 58.4316 41.8191 178.2198 36 A 3.9618 8.4810 121.7420 55.5890 19.0127 178.8328 37 T 4.1792 7.6979 108.4030 60.2108 66.4605 173.4475 38 L 4.0795 7.4893 126.0228 55.4026 43.7165 173.9297 39 N 4.7807 8.5129 125.1267 51.1422 39.5948 174.5649 40 Q 4.1550 8.6261 124.7784 57.1620 29.6440 177.8806 41 G 3.9105 8.8437 109.5889 46.0065 0.0000 173.6697 42 S 4.7162 7.8783 115.0467 56.8863 64.6245 173.1672 43 Q 4.8098 8.4728 125.0012 55.2831 30.4610 174.6903 44 A 4.5771 7.8431 123.9643 51.6901 22.9545 175.6240 45 R 5.0802 8.6342 122.4726 54.8600 31.5397 175.7283 46 L 4.3697 8.2379 123.7500 54.9066 43.9064 174.4047 47 V 3.7615 8.3102 123.1561 63.0830 32.4679 175.1733 48 T 4.9483 8.5299 124.1358 62.1562 72.1102 173.9005 49 A 4.1755 8.0643 117.0141 51.9948 22.2432 175.5470 50 M 4.5915 8.9326 122.4668 55.5424 32.7084 175.4536 51 V 4.2269 8.6288 127.2099 62.1629 33.2344 174.8478 52 V 4.6982 8.4398 126.6715 61.3832 34.3677 174.4655 53 R 4.7554 8.4841 124.7663 54.2052 34.5196 175.5851 54 E 4.0256 8.9673 119.7105 58.9051 29.4355 176.8509 55 D 5.0402 7.7894 116.9363 52.3166 40.0443 175.1050 56 S 4.6459 7.9015 113.7911 59.6575 67.8537 174.3545 57 M 4.7971 7.9425 116.1460 55.0018 34.0981 174.6225 58 T 4.4086 7.6716 114.4962 61.1969 69.8173 174.1527 59 L 5.2060 7.9917 124.9853 53.1060 45.3477 174.9151 60 Y 4.5696 8.8002 119.9561 55.9800 40.1184 174.9881 61 G 4.0687 8.7186 109.6814 44.4035 0.0000 171.6407 62 F 5.2681 9.3706 120.4277 55.0738 43.3364 176.0503 63 S 4.1250 9.0230 115.3963 61.4118 63.0841 174.1477 64 D 4.6633 7.7693 117.9542 50.5081 42.4038 175.8344 65 A 4.0879 8.7529 122.1131 56.2568 18.0989 178.8675 66 E 3.9734 8.0214 116.2322 58.8517 29.1868 178.2899 67 N 4.2292 10.8728 120.5440 55.3319 39.5077 176.6264 68 R 3.1982 7.5557 117.8849 58.1238 30.3389 178.1077 69 D 4.3105 7.6566 119.4193 57.0273 40.6802 178.9386 70 L 3.8796 7.7312 118.7164 57.8968 41.4265 178.5431 71 F 4.3717 7.9988 119.6748 61.6870 38.8139 176.6904 72 L 3.8548 8.2560 118.1197 58.7159 41.8295 178.8324 73 A 3.7506 8.6905 120.0142 54.9357 18.0380 179.1658 74 L 3.7593 9.0723 115.9677 57.5777 41.9829 179.5909 75 L 3.6191 8.2271 119.5478 58.4579 41.8966 178.7925 76 S 4.1286 8.3903 112.2196 60.4015 62.3835 174.2468 77 V 3.8014 7.5110 120.9120 62.3364 32.0101 175.2000 78 S 4.2701 8.3386 117.6845 58.5615 62.7102 172.7964 79 G 3.8713 7.5060 108.6068 44.5463 0.0000 179.6548 80 V 2.3529 7.9784 108.2778 58.6067 33.4244 178.4512 81 G 4.0542 8.9667 109.8600 45.4102 0.0000 172.8713 82 P 4.1770 0.0000 0.0000 65.0134 31.1058 177.8945 83 R 3.7780 7.5868 114.8329 60.3916 29.9852 178.3696 84 L 3.9578 7.9179 117.8910 56.2542 42.8226 181.5961 85 A 3.8623 7.8562 121.2376 57.8912 19.8141 178.8024 86 M 4.1650 8.9234 116.2966 57.5943 31.9507 179.1310 87 A 3.9424 8.4391 120.5168 56.1177 19.1457 179.1419 88 T 3.7965 8.6902 114.0785 67.6714 68.3717 176.2432 89 L 4.2476 8.5213 122.2014 57.0173 41.8837 179.2515 90 A 4.1713 8.2796 121.3939 55.7018 18.9065 178.8563 91 V 4.0832 7.9907 123.9795 62.2977 30.8218 176.3094 92 H 4.2646 8.8578 116.0246 55.7957 29.2922 175.8687 93 D 4.8432 8.7075 121.5722 53.1460 39.4525 177.3565 94 A 4.2711 8.6115 122.7929 51.7954 19.5498 180.3333 95 A 3.3541 9.9404 116.0125 54.0569 19.3933 180.7104 96 A 3.6413 8.0491 121.6647 53.6624 20.6974 178.5717 97 L 4.0069 8.4360 118.7205 56.3870 41.6264 179.9347 98 R 3.8445 7.5302 122.6686 59.4194 31.2426 178.5445 99 Q 3.9110 9.4852 120.0494 58.9710 27.6186 181.9699 100 A 4.1403 7.1318 121.6511 57.1389 20.1157 179.1616 101 L 3.6987 8.4598 115.2791 58.8436 41.6048 179.5981 102 A 3.7120 8.8303 118.8419 57.0370 18.6235 178.0948 103 D 4.3995 8.0850 112.0805 52.4111 40.6836 176.6301 104 S 3.8955 8.3548 114.4442 59.0260 62.2067 171.5559 105 D 4.2635 7.9533 122.0422 57.9314 41.9906 176.7245 106 V 3.7796 8.0525 121.1597 63.1194 30.3478 172.5948 107 A 3.8141 7.6491 117.9509 55.2468 18.5202 179.6999 108 S 4.0765 8.8027 112.1880 60.6357 64.5424 176.5934 109 L 3.1730 7.7365 114.9686 57.2288 41.3927 178.9198 110 T 3.6501 8.5624 124.5206 65.0080 68.7299 175.0095 111 R 4.0508 8.6116 120.3194 60.1652 29.2654 182.9012 112 V 3.8124 7.6457 109.6509 60.7535 32.2101 173.3326 113 P 4.6175 0.0000 0.0000 61.8394 33.0839 176.0249 114 G 3.9906 8.5728 103.0658 46.4185 0.0000 173.0952 115 I 4.3106 8.1569 120.6845 59.5033 38.7460 175.8575 116 G 4.2505 8.3765 114.1829 42.9348 0.0000 173.2749 117 R 3.7937 9.1792 119.1464 61.5117 28.6904 175.9041 118 R 4.5939 7.4400 117.9788 60.8144 31.6214 177.2295 119 G 3.7853 8.3519 105.0416 47.6606 0.0000 174.6995 120 A 4.1207 8.8398 123.6128 55.4575 18.5354 178.8319 121 E 3.7486 8.5627 115.4257 59.9622 29.2722 180.0658 122 R 3.8470 8.8972 120.3444 59.9096 30.7537 178.4556 123 I 3.7066 8.5256 120.1098 64.4501 37.1827 178.1927 124 V 3.5184 8.1409 118.5890 66.4455 31.2314 177.9534 125 L 3.9721 8.1124 118.6723 57.4175 41.9898 177.4331 126 E 4.6909 7.7811 118.1488 55.3122 30.9257 175.6245 127 L 4.6223 8.1089 116.5238 56.1619 49.8100 177.3772 128 A 4.0328 8.0092 120.4305 55.1286 18.8305 177.7495 129 D 4.3466 7.9679 113.1193 56.9241 41.6998 180.9668 130 K 4.3583 8.0618 124.8920 58.5134 33.0790 178.2904 131 V 3.6228 8.7309 115.6969 60.6449 30.4131 170.6697 132 G 3.8503 8.2694 108.8655 44.7189 0.0000 170.1728 133 P 4.0953 0.0000 0.0000 62.1218 31.8024 176.2431 *147 G 3.7892 8.1692 104.8872 45.8862 0.0000 173.9769 148 N 4.3600 8.3835 119.5504 56.4211 39.9139 176.3850 149 A 3.9257 8.1757 119.9571 55.3533 17.8815 179.2247 150 V 3.5171 7.9617 116.1519 66.6200 31.3025 178.1321 151 R 4.1063 8.6536 118.2145 59.1989 30.0005 177.6275 152 G 3.7708 9.5520 107.4181 45.4409 0.0000 176.5791 153 S 3.9592 7.8577 115.6928 61.3190 64.0652 175.7575 154 V 3.3730 7.9200 118.1377 66.4880 30.9199 178.3042 155 V 3.4079 7.9121 116.4346 65.9944 31.7585 177.7499 156 E 4.0819 8.2961 118.3003 60.2236 29.3918 178.4472 157 A 3.8459 8.3339 119.0444 55.6243 18.3354 179.1154 158 L 4.1178 8.2861 115.0167 58.0086 42.0132 180.3044 159 V 3.8998 8.7081 118.8721 66.0947 31.2302 177.6878 160 G 3.8173 10.4146 103.7028 48.1913 0.0000 175.0931 161 L 4.1027 8.5336 120.9164 55.1309 41.7690 178.2512 162 G 3.8927 8.1102 108.0727 44.9725 0.0000 173.9702 163 F 4.5095 7.8146 117.9486 56.9645 39.9256 174.5169 164 A 4.5188 8.4737 124.3284 50.8055 20.0263 178.0550 165 A 4.3964 8.3812 124.3901 52.5787 19.6541 176.9185 166 K 4.5811 8.5314 113.1246 56.6582 31.5769 174.2018 167 Q 4.3887 7.6456 124.0915 57.9135 32.9934 174.1663 168 A 4.0223 7.4111 122.2598 54.0502 19.2952 178.8814 169 E 4.4576 8.2339 111.4517 58.8104 29.7141 177.9958 170 E 4.5913 7.9437 119.1743 52.8653 27.4110 176.3625 171 A 5.2882 7.6904 135.0000 53.3125 18.2307 178.9390 172 T 3.8603 6.7954 113.2568 66.3217 68.2396 176.1040 173 D 4.3410 8.8635 120.0746 58.5389 40.9799 180.0007 174 Q 3.7094 7.5851 118.7267 59.7669 29.8987 178.8578 175 V 3.6736 8.3904 120.6413 64.0284 31.4208 177.3441 176 L 3.9529 7.8016 118.8515 58.1194 43.2127 178.0628 177 D 4.9987 8.1454 118.4883 52.0976 39.3507 176.0218 178 G 4.1732 8.2347 113.5032 46.2619 0.0000 172.1932 179 E 3.1224 7.9486 119.3569 53.1080 32.5043 175.4631 *187 A 4.0460 8.0441 123.9184 53.5588 19.2176 178.9907 188 T 3.5677 7.3700 117.7728 64.4245 69.3524 173.8763 189 S 4.6331 8.9305 117.7760 59.6624 64.7156 176.2384 190 S 4.1958 8.2867 113.3461 61.0130 64.1116 175.9811 191 A 3.9326 9.0391 123.2319 53.4385 16.6192 181.3696 192 L 3.2876 8.0594 121.4035 55.8355 44.8144 175.5884 193 R 4.0191 8.1661 116.7942 59.1862 30.2047 178.0908 194 A 4.1875 12.0000 121.0021 53.5286 18.7301 178.9710 195 A 3.8127 7.7987 116.7873 55.4705 18.4415 179.5518 196 L 3.9432 7.8282 115.9930 58.1335 41.9007 179.3905 197 S 4.2275 7.3591 111.4657 62.0998 62.3523 175.0119 198 L 4.0992 8.8979 124.0170 55.5972 41.3992 178.6059 199 L 3.4368 8.7775 121.2433 56.8805 41.9092 178.8443 200 G 3.7199 9.2757 108.1605 47.1725 0.0000 178.8824 201 K 3.4999 6.7963 115.3547 55.6789 35.3940 174.6154 202 T 4.1633 7.9533 131.1515 62.7367 68.9131 175.9156 *203 R 4.1540 8.3614 123.9609 56.2986 30.1278 172.8299 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 M 8.30 4.42 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 2 I 7.82 4.54 1.92 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.90 0.93 0.00 0.00 3 F 8.50 5.24 0.00 2.84 3.02 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 0.00 0.00 0.00 4 S 7.96 4.81 0.00 3.85 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 5 V 7.97 4.28 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 0.92 0.00 0.00 0.63 0.00 0.00 6 R 8.32 4.49 0.00 1.87 1.82 0.00 3.33 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 7 G 8.88 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 8 E 8.20 5.04 0.00 2.12 1.81 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 2.20 2.22 0.00 9 V 8.96 3.82 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 0.92 0.00 0.00 0.97 0.00 0.00 10 L 9.06 4.36 0.00 1.55 1.51 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.10 4.48 0.00 2.00 1.78 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 2.30 2.22 0.00 12 V 8.15 4.53 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 0.83 0.00 0.00 0.92 0.00 0.00 13 A 8.13 4.31 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 14 L 8.17 4.15 0.00 1.61 1.66 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 15 D 7.15 4.56 0.00 2.72 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 16 H 8.01 4.44 0.00 3.07 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.04 4.83 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.32 4.88 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 1.03 0.00 0.00 0.94 0.00 0.00 19 I 8.39 4.98 1.95 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 1.13 0.58 1.00 0.00 0.00 20 E 9.01 4.79 0.00 2.07 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 0.00 2.42 2.26 0.00 21 A 9.47 4.36 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.62 3.54 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 23 G 8.34 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 24 I 8.27 3.73 1.63 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.32 0.24 0.00 0.00 25 G 8.14 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 0.00 0.00 0.00 0.00 26 Y 9.20 4.62 0.00 2.92 2.87 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 0.00 0.00 0.00 0.00 27 R 8.56 4.28 0.00 1.73 1.73 0.00 3.01 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.36 0.00 28 V 8.60 4.30 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 0.78 0.00 0.00 0.95 0.00 0.00 29 N 7.98 4.40 0.00 2.39 2.65 0.00 0.00 6.62 7.20 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 30 A 7.70 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 7.45 4.62 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 1.20 0.00 0.00 32 P 0.00 4.14 0.00 2.28 2.37 0.00 3.74 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 2.10 2.11 0.00 33 S 7.52 4.13 0.00 3.94 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 34 A 8.65 4.34 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 35 L 7.91 3.83 0.00 1.60 1.77 1.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.48 3.96 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 37 T 7.70 4.18 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 38 L 7.49 4.08 0.00 1.67 1.56 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.51 4.78 0.00 2.77 2.72 0.00 0.00 6.64 8.17 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 40 Q 8.63 4.16 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.05 0.00 0.00 0.00 0.00 0.00 2.35 2.71 0.00 41 G 8.84 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 0.00 0.00 0.00 42 S 7.88 4.72 0.00 3.90 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 43 Q 8.47 4.81 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 44 A 7.84 4.58 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 45 R 8.63 5.08 0.00 1.82 1.81 0.00 3.29 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 46 L 8.24 4.37 0.00 1.88 1.71 0.88 0.76 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 47 V 8.31 3.76 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 1.00 0.00 0.00 0.94 0.00 0.00 48 T 8.53 4.95 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 1.27 0.00 0.00 49 A 8.06 4.18 1.53 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 50 M 8.93 4.59 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 51 V 8.63 4.23 2.43 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 0.95 0.00 0.00 1.07 0.00 0.00 52 V 8.44 4.70 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 0.92 0.00 0.00 0.98 0.00 0.00 53 R 8.48 4.76 0.00 1.81 1.78 0.00 3.38 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 54 E 8.97 4.03 0.00 1.93 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 2.33 0.00 55 D 7.79 5.04 0.00 2.76 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 56 S 7.90 4.65 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 M 7.94 4.80 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 58 T 7.67 4.41 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 1.41 0.00 0.00 59 L 7.99 5.21 0.00 1.46 1.42 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.80 4.57 0.00 2.73 2.26 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 61 G 8.72 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 62 F 9.37 5.27 0.00 2.82 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 63 S 9.02 4.13 0.00 4.00 4.05 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 0.00 0.00 0.00 64 D 7.77 4.66 0.00 3.05 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 65 A 8.75 4.09 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 66 E 8.02 3.97 0.00 2.49 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 0.00 2.32 2.39 0.00 67 N 10.87 4.23 0.00 2.74 2.79 0.00 0.00 7.14 7.54 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 68 R 7.56 3.20 0.00 1.92 2.17 0.00 2.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.46 0.00 69 D 7.66 4.31 0.00 2.88 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 70 L 7.73 3.88 0.00 1.63 1.67 0.89 0.97 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 71 F 8.00 4.37 0.00 2.53 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 72 L 8.26 3.85 0.00 1.69 1.69 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.69 3.75 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 74 L 9.07 3.76 0.00 1.48 1.70 1.09 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.23 3.62 0.00 0.66 1.52 0.64 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.39 4.13 0.00 3.80 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 77 V 7.51 3.80 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 0.79 0.00 0.00 0.93 0.00 0.00 78 S 8.34 4.27 0.00 3.88 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 79 G 7.51 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.98 2.35 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 0.70 0.00 0.00 0.99 0.00 0.00 81 G 8.97 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.18 0.00 2.27 1.56 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 83 R 7.59 3.78 0.00 1.90 1.89 0.00 3.17 0.00 0.00 3.35 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.97 0.00 84 L 7.92 3.96 0.00 1.75 1.57 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.86 3.86 1.15 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 86 M 8.92 4.17 0.00 2.15 2.59 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.86 0.00 87 A 8.44 3.94 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 88 T 8.69 3.80 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 1.24 0.00 0.00 89 L 8.52 4.25 0.00 1.84 1.81 0.99 1.01 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 90 A 8.28 4.17 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 91 V 7.99 4.08 2.18 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 0.70 0.00 0.00 0.93 0.00 0.00 92 H 8.86 4.26 0.00 3.19 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.71 4.84 0.00 2.80 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 94 A 8.61 4.27 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 95 A 9.94 3.35 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 96 A 8.05 3.64 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 97 L 8.44 4.01 0.00 1.94 1.51 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.53 3.84 0.00 1.94 1.94 0.00 3.26 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 99 Q 9.49 3.91 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.37 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 100 A 7.13 4.14 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 0.00 101 L 8.46 3.70 0.00 1.92 1.68 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.83 3.71 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 0.00 103 D 8.08 4.40 0.00 2.88 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 0.00 104 S 8.35 3.90 0.00 4.01 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 7.95 4.26 0.00 2.65 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 0.00 106 V 8.05 3.78 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 0.87 0.00 0.00 0.97 0.00 0.00 107 A 7.65 3.81 1.37 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 0.00 108 S 8.80 4.08 0.00 4.01 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.74 3.17 0.00 2.09 1.55 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 118 R 7.44 4.59 0.00 1.92 1.91 0.00 3.25 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 1.69 1.67 0.00 119 G 8.35 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.84 4.12 1.37 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 0.00 121 E 8.56 3.75 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 2.34 2.39 0.00 122 R 8.90 3.85 0.00 1.93 2.00 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 123 I 8.53 3.71 1.98 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 1.64 0.78 0.89 0.00 0.00 124 V 8.14 3.52 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 0.99 0.00 0.00 0.99 0.00 0.00 125 L 8.11 3.97 0.00 1.62 1.81 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 E 7.78 4.69 0.00 2.21 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 2.22 2.45 0.00 127 L 8.11 4.62 0.00 1.75 1.61 0.94 0.59 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 0.00 128 A 8.01 4.03 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 7.97 4.35 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.06 4.36 0.00 1.89 1.66 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 131 V 8.73 3.62 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 0.66 0.00 0.00 0.91 0.00 0.00 132 G 8.27 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 0.00 133 P 0.00 4.10 0.00 2.04 2.09 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 *147 G 8.17 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 8.38 4.36 0.00 2.77 2.82 0.00 0.00 6.90 8.15 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 0.00 149 A 8.18 3.93 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 0.00 150 V 7.96 3.52 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 1.02 0.00 0.00 0.93 0.00 0.00 151 R 8.65 4.11 0.00 1.89 1.94 0.00 3.30 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 152 G 9.55 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 0.00 153 S 7.86 3.96 0.00 3.90 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 V 7.92 3.37 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 1.00 0.00 0.00 1.08 0.00 0.00 155 V 7.91 3.41 2.39 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 0.95 0.00 0.00 0.96 0.00 0.00 156 E 8.30 4.08 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 157 A 8.33 3.85 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 0.00 158 L 8.29 4.12 0.00 2.01 1.96 1.07 0.79 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 0.00 159 V 8.71 3.90 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 1.12 0.00 0.00 0.99 0.00 0.00 160 G 10.41 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.53 4.10 0.00 1.44 1.60 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 162 G 8.11 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 0.00 163 F 7.81 4.51 0.00 3.18 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 0.00 164 A 8.47 4.52 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 0.00 165 A 8.38 4.40 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 0.00 166 K 8.53 4.58 0.00 1.95 1.95 0.00 1.23 0.00 0.00 2.29 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.37 7.81 167 Q 7.65 4.39 0.00 1.94 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.14 0.00 0.00 0.00 0.00 0.00 2.14 2.38 0.00 168 A 7.41 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 0.00 169 E 8.23 4.46 0.00 2.14 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 0.00 2.40 2.32 0.00 170 E 7.94 4.59 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 2.29 2.28 0.00 171 A 7.69 5.29 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 0.00 172 T 6.80 3.86 4.28 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 1.20 0.00 0.00 173 D 8.86 4.34 0.00 2.66 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 0.00 174 Q 7.59 3.71 0.00 2.02 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.11 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 175 V 8.39 3.67 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 0.93 0.00 0.00 1.03 0.00 0.00 176 L 7.80 3.95 0.00 1.78 1.68 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 177 D 8.15 5.00 0.00 2.70 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 0.00 178 G 8.23 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 E 7.95 3.12 0.00 2.15 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 2.29 2.29 0.00 *187 A 8.04 4.05 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 0.00 188 T 7.37 3.57 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 189 S 8.93 4.63 0.00 3.86 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 0.00 190 S 8.29 4.20 0.00 3.97 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 0.00 191 A 9.04 3.93 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 0.00 192 L 8.06 3.29 0.00 1.83 1.90 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 193 R 8.17 4.02 0.00 1.94 2.00 0.00 3.17 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 194 A 12.00 4.19 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 0.00 195 A 7.80 3.81 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 0.00 196 L 7.83 3.94 0.00 1.71 1.88 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 197 S 7.36 4.23 0.00 3.99 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 0.00 198 L 8.90 4.10 0.00 1.62 1.62 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 199 L 8.78 3.44 0.00 1.72 1.44 0.79 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 200 G 9.28 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 0.00 201 K 6.80 3.50 0.00 1.84 1.95 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.42 7.81 202 T 7.95 4.16 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 *203 R 8.36 4.15 0.00 1.58 1.75 0.00 3.23 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.70 0.00 * Residues marked with a * may have inaccurate shift predictions.