NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.6366 8.1776 115.5668 58.7737 64.4713 172.5769 2 T 4.8329 8.3749 113.8475 59.2699 70.9990 172.5338 3 L 4.0454 8.3561 121.2345 54.5091 44.2303 179.9490 4 G 4.0876 7.3467 110.9423 45.5763 0.0000 176.7170 5 T 3.8847 8.2213 122.8109 63.1108 69.4490 172.4695 6 V 4.5697 8.0357 125.2940 61.3267 33.2857 174.2950 7 H 4.6839 9.0755 125.8428 55.0329 30.4022 174.6711 8 N 4.6967 8.7362 119.4719 53.5651 39.3152 174.8227 9 Y 4.1908 9.1724 126.5991 56.0810 38.8273 176.6550 10 G 3.9306 8.1648 114.6970 45.2204 0.0000 171.1448 11 D 5.0334 8.5942 120.0570 53.3626 40.3760 176.7279 12 Q 4.9097 7.9148 117.1200 55.7067 30.4105 174.1398 13 A 5.1475 8.0213 119.3097 51.4961 23.4589 175.9421 14 L 5.2119 8.8581 118.6928 52.8258 45.9554 175.5062 15 L 4.9820 9.0213 125.8192 53.3963 44.2765 174.8149 16 L 4.6742 8.9361 127.6473 53.5105 43.3150 175.6455 17 E 4.7195 8.0825 123.6215 55.0176 30.9310 175.5900 18 F 5.0122 8.7665 121.3662 56.0382 42.8873 174.8638 19 D 4.6768 8.5278 119.0402 55.7672 41.3884 177.3134 20 S 4.7509 7.5868 113.1081 56.3772 67.0372 175.0673 21 T 4.0590 8.6027 119.1740 66.5939 68.2963 176.9037 22 A 4.0316 8.0799 122.4704 55.3232 18.3953 179.4080 23 E 3.9501 8.0592 117.2289 59.2366 29.4928 179.6057 24 V 3.1253 7.3966 117.9982 65.9753 31.4761 178.1555 25 L 3.9850 8.1428 118.5383 57.6969 41.4864 179.4526 26 A 3.8971 7.9985 120.7218 54.9852 18.2600 179.7941 27 W 3.9014 8.1513 117.5468 59.8692 28.9102 178.8729 28 T 3.9143 8.1024 115.8996 66.7907 67.8487 176.4262 29 E 3.9483 7.9368 120.1974 59.5775 29.4774 179.4175 30 T 3.7639 7.7064 115.6222 66.7368 68.3213 176.5418 31 L 4.0923 8.1000 119.5312 57.9316 41.4501 179.5257 32 R 4.0865 8.3006 118.2226 59.4891 29.8290 179.0770 33 E 4.0677 8.3292 116.9539 59.0066 29.5084 178.9239 34 A 4.0443 7.9882 120.0951 52.6818 19.3311 176.9857 35 E 3.7335 7.7523 115.3308 57.1897 27.4966 175.5706 36 L 4.0841 7.4464 117.8539 54.4297 42.8159 177.2603 37 L 3.9666 8.3176 125.0176 56.3898 42.7026 177.2407 38 G 2.6741 8.5368 113.2798 44.8491 0.0000 172.7530 39 V 4.0710 7.0179 119.8338 62.6423 31.8841 175.5950 40 V 4.0630 8.6365 127.8005 64.8842 32.5896 175.2480 41 D 4.6738 7.6514 116.9517 53.2233 44.7822 174.2655 42 I 4.7339 8.3300 123.5131 59.8640 39.7579 175.8593 43 V 4.2843 9.0414 129.8372 60.2217 31.2149 172.9126 44 P 4.7573 0.0000 0.0000 62.5898 32.4487 175.8189 45 A 3.2175 7.7968 122.4582 50.6955 22.1376 175.5138 46 A 4.4711 8.4781 119.1283 55.7062 18.4325 179.0957 47 R 5.0049 7.8941 110.9722 55.8456 33.3722 174.6922 48 T 5.2397 7.7177 108.9089 60.5060 73.1192 172.5054 49 V 4.7808 8.7985 121.2060 61.1490 34.8895 173.6020 50 L 4.7885 8.6943 130.5790 53.6476 43.8602 175.1401 51 V 4.4990 8.7816 127.9050 61.4100 33.0331 174.4959 52 K 4.7520 9.0111 129.1454 55.4826 33.4595 176.2678 53 L 5.2311 8.6084 124.3260 52.6898 44.1054 176.8847 54 A 4.1388 9.1496 123.5836 54.6014 19.1075 177.7849 55 G 4.2856 8.0953 102.2453 43.1710 0.0000 172.5267 56 P 5.1437 0.0000 0.0000 64.8926 30.9155 179.1029 57 R 3.8544 7.8880 113.6973 59.3524 29.3966 177.7702 58 Y 4.3722 7.7460 115.7510 59.4815 38.0185 177.1115 59 Q 3.9638 8.1077 121.3370 59.3029 29.1068 178.1744 60 A 3.9940 7.8746 120.8171 54.7912 18.6538 177.5074 61 P 4.2216 0.0000 0.0000 66.1468 31.3117 178.9829 62 T 3.9319 8.0833 114.4767 66.5087 68.1515 176.6210 63 R 3.8690 7.8176 119.5192 59.4613 30.2494 177.9972 64 Q 4.1135 8.2628 119.2107 59.4065 29.1225 178.3379 65 R 3.9775 8.0641 118.9716 59.4102 30.0837 178.8405 66 L 4.2033 8.4281 119.1408 58.0411 41.4238 179.9320 67 G 3.7281 7.8273 104.3803 46.9218 0.0000 174.9192 68 K 4.3967 7.8680 118.4048 55.7939 33.0240 176.9237 69 L 4.2456 7.3078 119.9298 54.4470 42.2816 176.0182 70 R 4.6676 8.1990 123.1527 53.9713 31.9456 175.5597 71 V 2.7462 7.3589 127.0343 61.3988 31.4326 176.4519 72 R 4.0845 8.1449 123.4109 54.6747 30.2639 174.8736 73 P 4.0626 0.0000 0.0000 63.2688 31.1805 175.5876 74 E 4.0080 8.7167 120.9477 56.1134 29.9452 176.7589 75 A 4.5001 8.6409 124.9741 52.5349 18.6395 178.3152 76 I 3.9274 7.4888 118.3381 63.2873 38.0192 177.2936 77 T 4.0680 7.5893 115.9728 65.6777 68.5072 174.7915 78 H 4.6780 7.3360 122.1674 54.9091 28.1872 174.0834 79 Q 4.5714 8.1556 122.4256 56.5605 29.2825 174.8249 80 P 4.3904 0.0000 0.0000 60.7194 32.7392 174.9949 81 P 2.9700 0.0000 0.0000 63.3402 31.5280 176.6953 82 G 4.2197 8.5081 110.1694 45.1510 0.0000 172.6196 83 D 4.3061 6.4837 121.7994 53.9629 47.3800 175.2961 84 R 4.2486 7.9049 117.8663 55.4543 31.3203 176.5361 85 V 4.4225 7.9197 119.2117 60.3328 33.2522 175.8474 86 D 4.7440 8.7765 123.5209 57.1820 41.4197 177.1299 87 V 4.5714 7.6575 115.7979 60.4979 35.0772 173.7430 88 T 4.9945 8.4740 118.8377 61.9627 70.9241 173.3280 89 I 4.4099 8.6236 127.9416 59.6258 39.4730 174.4769 90 D 5.1877 8.7424 127.5161 53.5865 41.8947 176.0153 91 V 4.3824 9.1999 123.6659 60.9040 34.8912 174.3224 92 V 4.2176 8.2532 128.0702 61.3270 32.4541 175.7505 93 Y 4.6737 8.3679 129.4268 56.4703 36.0812 175.2410 94 D 5.0149 7.6955 116.4661 52.6192 40.6714 177.5815 95 G 3.7404 7.9614 108.2204 45.9760 0.0000 175.1978 96 A 3.9719 8.6532 124.6158 54.5427 18.7499 178.3289 97 D 4.8278 8.2483 113.6424 54.1142 41.7539 177.7822 98 L 3.9437 7.8735 123.4016 59.0273 41.9356 178.9791 99 H 4.1582 8.2952 115.2238 58.6147 28.5753 177.3739 100 E 3.9326 8.0695 120.9096 59.1675 29.5332 178.7547 101 V 3.5430 8.3026 118.5510 65.8336 31.4519 177.6501 102 A 3.9641 7.9843 120.4132 55.4368 18.0220 179.7143 103 S 4.0699 7.7339 111.8984 61.9296 63.0297 176.8228 104 L 4.1631 8.0015 120.6872 57.5355 41.4810 178.8643 105 T 4.2389 8.2332 107.7243 61.0637 70.4059 174.0055 106 G 3.4786 7.5429 109.2830 46.8287 0.0000 173.4653 *108 T 4.1129 7.1470 108.8040 60.7913 71.7742 172.7242 109 P 4.1696 0.0000 0.0000 65.6146 31.2721 178.7961 110 A 3.9307 7.8993 119.1361 55.4081 18.3137 179.6045 111 Q 3.9537 7.9708 116.1310 58.7356 28.6502 179.1328 112 V 3.5329 7.7233 119.4260 66.0706 31.6463 178.0978 113 I 3.0140 7.4999 119.2154 64.1724 36.8946 178.3182 114 A 3.9555 7.9692 121.2635 55.0526 18.3099 179.6143 115 A 3.9470 8.2235 119.4613 55.5510 18.2668 179.3467 116 H 4.5153 8.3082 116.1243 59.4821 30.0607 177.0101 117 T 4.8135 7.5200 111.2819 62.8234 69.1547 176.7677 118 G 3.8159 8.0532 108.3673 45.6382 0.0000 173.9126 119 T 4.5619 6.8969 116.3357 60.6402 70.8338 172.3409 120 P 4.8646 0.0000 0.0000 62.6052 32.3564 175.6554 121 W 5.0900 9.7779 121.9591 55.1041 32.6055 174.6211 122 R 4.1260 9.1499 124.0950 54.0286 32.1564 175.4503 123 V 3.9020 8.0119 126.0286 61.6775 31.9760 176.8339 124 G 3.7823 9.0311 114.4221 48.3867 0.0000 172.7117 125 F 5.1198 7.3240 114.4450 55.6153 41.3867 172.2372 126 C 5.2837 8.6028 116.8065 58.1976 30.5903 174.4068 127 G 4.0227 8.6708 107.1133 47.5126 0.0000 171.9806 128 F 3.9185 9.7683 125.5458 58.7461 39.0495 175.6838 129 A 4.3132 7.1941 119.7040 50.0640 21.6353 173.4836 130 P 4.0595 0.0000 0.0000 64.0926 31.3255 177.4474 131 G 3.9827 8.8359 111.7310 44.9455 0.0000 172.5470 132 F 4.1322 8.2926 123.3855 57.4922 40.1961 173.8497 133 A 5.0068 7.5807 128.1940 50.2382 21.1952 175.2016 134 Y 4.0345 8.8715 121.3780 57.1352 39.0032 174.6844 135 L 5.0626 8.9720 125.8588 53.7771 43.8252 176.5364 136 V 4.8767 9.0849 115.9409 59.9329 36.3522 175.4601 137 D 4.4863 8.8102 117.4604 55.4767 37.9868 175.0759 138 G 2.0000 6.7347 109.0253 43.3997 0.0000 172.7166 139 D 4.1127 7.7531 118.9970 54.0706 41.3066 177.7240 140 A 4.0803 8.5190 130.3044 54.8679 18.7092 179.3650 141 R 4.0026 7.9230 114.4276 59.1563 30.1357 178.0323 142 L 4.1450 7.6820 115.8737 56.1480 41.8240 176.6500 143 Q 4.6941 7.9281 118.0336 55.8908 29.1664 176.7141 144 V 4.6470 8.1708 123.2900 58.9483 35.0757 173.5272 145 P 4.7579 0.0000 0.0000 62.2637 32.3753 176.0610 146 R 4.1185 8.3711 119.3960 55.9493 30.6772 177.0857 147 R 4.1049 8.7155 119.1830 55.9600 30.7424 177.0295 148 A 4.2033 8.8406 124.8766 54.9190 18.4029 177.8607 149 E 4.7764 7.7567 112.5568 53.6752 32.6921 174.4930 150 P 4.5112 0.0000 0.0000 62.4033 32.4896 176.5548 151 R 4.2744 8.6501 120.3230 56.1647 31.0467 178.4043 152 T 3.9214 8.4403 117.6555 66.2482 68.8291 174.7688 153 S 4.5995 7.7311 114.8969 56.7699 65.3254 173.5526 154 V 4.4692 8.6143 121.1538 58.5273 34.1855 173.9230 155 P 4.6571 0.0000 0.0000 62.2047 32.8242 175.5819 156 A 4.1263 8.3848 124.4151 53.8370 18.9481 178.1991 157 G 4.0371 9.7791 110.6849 45.9892 0.0000 172.8141 158 A 4.4915 7.8505 122.7734 52.1659 19.4978 177.0137 159 V 4.4549 8.7279 123.7297 61.7149 33.1729 174.8476 160 A 5.4384 9.0819 128.7706 50.4774 23.5868 174.1566 161 L 5.1293 9.0498 117.6564 53.3278 46.4198 176.3419 162 A 4.2022 8.5917 120.3405 50.9123 23.1916 176.3609 163 G 3.5938 9.0005 113.6644 47.1205 0.0000 175.1670 164 E 4.2636 8.4414 122.2149 56.2317 30.0928 175.6396 165 F 6.0607 7.7903 118.9289 55.5685 42.2793 174.4124 166 S 4.9436 8.1109 113.9979 56.8946 66.0683 172.5641 167 G 3.8526 8.3778 108.5519 45.4501 0.0000 172.3352 168 V 4.7548 7.4199 120.6841 60.6471 33.6915 174.7282 169 Y 4.3570 8.9573 126.9978 57.5979 37.9699 175.5531 170 P 4.4047 0.0000 0.0000 65.1022 31.8851 176.2440 171 R 4.8404 7.6420 114.8980 53.5350 34.5608 175.0283 172 Q 4.4924 8.9201 122.0224 56.3602 29.5268 175.3331 173 S 4.7245 8.2307 119.2541 56.7047 66.2838 172.3365 174 P 4.7091 0.0000 0.0000 62.7311 32.0428 176.0085 175 G 4.0543 8.6723 106.3500 45.5398 0.0000 173.9206 176 G 4.2783 8.8589 111.2808 44.9301 0.0000 173.3293 177 W 4.8049 7.8801 119.5921 56.0699 30.5846 176.0019 178 Q 4.4217 9.1690 124.4144 55.7780 29.6608 174.8961 179 L 4.9749 9.6081 128.9657 54.4531 41.9407 177.4625 180 I 4.2615 8.8267 117.9490 60.6604 39.7984 175.8899 181 G 4.2746 7.2999 109.1504 46.5854 0.0000 171.2805 182 H 5.2561 7.8929 113.8104 54.4672 31.6808 172.2623 183 T 4.8873 8.8683 115.0972 60.6971 70.0062 174.0690 184 D 4.8137 8.4710 123.7179 53.8668 41.6166 176.9212 185 A 4.0732 7.5444 123.0336 52.0957 18.8601 177.9409 186 V 3.8852 7.9621 121.4523 61.8147 32.7987 175.0658 *188 F 4.5418 8.2027 124.3100 57.9883 40.1884 173.9521 189 D 4.3890 8.1255 127.5373 52.5137 43.3132 176.1351 190 V 3.4349 8.2874 127.1392 64.2096 31.4544 176.6922 191 N 4.5769 8.1154 115.9740 53.4463 39.0533 175.3491 192 R 4.1466 7.5113 118.6136 55.5076 30.9634 175.7411 193 D 4.3884 8.7524 123.8440 56.5917 40.9228 176.6003 194 K 4.4010 7.5740 118.2408 53.5520 32.5579 173.7802 195 P 4.7310 0.0000 0.0000 64.2972 31.4828 176.6148 196 A 4.7979 7.7131 119.4081 50.8193 19.6636 176.9914 197 L 4.0186 8.7434 125.2379 57.0844 42.4853 176.9582 198 L 4.6148 7.7834 118.2027 53.1346 43.0182 175.5664 199 T 4.6351 8.1704 120.2204 60.5578 70.9013 172.5294 200 P 4.2495 0.0000 0.0000 64.7719 32.1424 176.9825 201 G 3.8240 8.6727 112.0168 45.5431 0.0000 173.8059 *203 W 4.6914 7.6458 116.9601 56.3499 31.4861 176.1391 204 V 4.8418 9.4896 124.7193 61.0364 34.1616 173.7495 205 Q 5.0001 8.7638 128.3120 54.3957 31.3785 174.0272 206 F 5.2831 8.8931 124.5267 56.2856 41.6448 174.5866 207 R 4.9265 9.2561 122.6973 54.3872 33.0737 174.0769 208 A 5.0529 8.9767 128.5017 52.2945 18.9739 177.2062 209 V 4.4118 8.6675 113.4431 60.3320 34.5018 176.3343 210 G 3.7743 7.9159 115.4503 46.2870 0.0000 173.4427 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 8.18 4.64 0.00 4.02 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 2 T 8.37 4.83 4.33 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 1.33 0.00 0.00 3 L 8.36 4.05 0.00 1.46 1.29 0.72 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.35 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.22 3.88 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 6 V 8.04 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 0.75 0.00 0.00 0.74 0.00 0.00 7 H 9.08 4.68 0.00 3.14 3.19 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.74 4.70 0.00 2.62 2.93 0.00 0.00 6.73 7.46 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 9 Y 9.17 4.19 0.00 2.97 2.80 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 10 G 8.16 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.59 5.03 0.00 2.82 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 7.91 4.91 0.00 2.17 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 13 A 8.02 5.15 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 14 L 8.86 5.21 0.00 1.57 1.51 0.99 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 L 9.02 4.98 0.00 1.77 1.63 0.81 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.94 4.67 0.00 1.71 1.03 0.92 0.77 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 17 E 8.08 4.72 0.00 1.60 1.69 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 2.21 2.19 0.00 18 F 8.77 5.01 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 19 D 8.53 4.68 0.00 2.93 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 20 S 7.59 4.75 0.00 4.05 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 21 T 8.60 4.06 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 1.71 0.00 0.00 22 A 8.08 4.03 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 23 E 8.06 3.95 0.00 2.21 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 2.46 2.39 0.00 24 V 7.40 3.13 2.21 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 0.95 0.00 0.00 1.15 0.00 0.00 25 L 8.14 3.99 0.00 1.75 1.73 1.05 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.00 3.90 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 27 W 8.15 3.90 0.00 3.00 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 28 T 8.10 3.91 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 1.23 0.00 0.00 29 E 7.94 3.95 0.00 2.00 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 2.48 0.00 30 T 7.71 3.76 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 1.05 0.00 0.00 31 L 8.10 4.09 0.00 1.83 1.80 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.30 4.09 0.00 2.11 1.98 0.00 3.14 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 33 E 8.33 4.07 0.00 2.11 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 2.33 2.42 0.00 34 A 7.99 4.04 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 35 E 7.75 3.73 0.00 2.11 1.97 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 2.26 2.37 0.00 36 L 7.45 4.08 0.00 1.71 1.60 0.97 0.53 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 37 L 8.32 3.97 0.00 1.62 1.66 0.96 1.30 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 38 G 8.54 2.67 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 0.00 0.00 0.00 39 V 7.02 4.07 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 0.94 0.00 0.00 40 V 8.64 4.06 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 0.76 0.00 0.00 0.91 0.00 0.00 41 D 7.65 4.67 0.00 2.71 2.41 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 42 I 8.33 4.73 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 1.24 0.80 0.93 0.00 0.00 43 V 9.04 4.28 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 0.93 0.00 0.00 0.88 0.00 0.00 44 P 0.00 4.76 0.00 1.85 1.95 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 45 A 7.80 3.22 0.97 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 0.00 0.00 46 A 8.48 4.47 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.89 5.00 0.00 1.74 2.07 0.00 3.54 0.00 0.00 3.51 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 48 T 7.72 5.24 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 1.18 0.00 0.00 49 V 8.80 4.78 2.28 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 0.88 0.00 0.00 1.03 0.00 0.00 50 L 8.69 4.79 0.00 1.59 1.37 0.63 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.78 4.50 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 0.91 0.00 0.00 0.95 0.00 0.00 52 K 9.01 4.75 0.00 1.70 1.69 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.35 7.81 53 L 8.61 5.23 0.00 1.68 1.62 1.06 0.99 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 54 A 9.15 4.14 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.10 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 0.00 0.00 0.00 0.00 56 P 0.00 5.14 0.00 2.16 2.13 0.00 3.90 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 57 R 7.89 3.85 0.00 1.73 1.90 0.00 2.61 0.00 0.00 2.99 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.77 0.00 58 Y 7.75 4.37 0.00 3.21 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 59 Q 8.11 3.96 0.00 2.37 2.12 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 2.39 2.43 0.00 60 A 7.87 3.99 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 61 P 0.00 4.22 0.00 2.26 2.17 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.19 0.00 62 T 8.08 3.93 4.45 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 1.25 0.00 0.00 63 R 7.82 3.87 0.00 1.83 2.13 0.00 3.26 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 64 Q 8.26 4.11 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 65 R 8.06 3.98 0.00 1.96 2.03 0.00 3.23 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 66 L 8.43 4.20 0.00 2.04 1.73 1.03 0.90 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 G 7.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.87 4.40 0.00 1.94 1.90 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.50 7.81 69 L 7.31 4.25 0.00 2.15 1.96 1.03 1.39 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 70 R 8.20 4.67 0.00 1.78 1.74 0.00 3.22 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.55 0.00 71 V 7.36 2.75 0.67 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 0.61 0.00 0.00 -0.08 0.00 0.00 72 R 8.14 4.08 0.00 1.73 1.81 0.00 3.02 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.46 0.00 73 P 0.00 4.06 0.00 2.16 2.12 0.00 3.68 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 1.96 1.95 0.00 74 E 8.72 4.01 0.00 2.16 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 0.00 2.33 2.30 0.00 75 A 8.64 4.50 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 76 I 7.49 3.93 1.91 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 1.46 0.55 0.97 0.00 0.00 77 T 7.59 4.07 4.27 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 1.22 0.00 0.00 78 H 7.34 4.68 0.00 3.05 3.47 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.16 4.57 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 80 P 0.00 4.39 0.00 1.96 1.98 0.00 3.34 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 1.79 1.83 0.00 81 P 0.00 2.97 0.00 1.47 0.80 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 0.00 82 G 8.51 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 6.48 4.31 0.00 2.50 2.37 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 84 R 7.90 4.25 0.00 1.95 1.89 0.00 3.07 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 85 V 7.92 4.42 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 0.85 0.00 0.00 1.03 0.00 0.00 86 D 8.78 4.74 0.00 2.82 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.66 4.57 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 0.69 0.00 0.00 0.90 0.00 0.00 88 T 8.47 4.99 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 1.23 0.00 0.00 89 I 8.62 4.41 1.63 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.67 1.05 0.00 0.00 90 D 8.74 5.19 0.00 2.57 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 91 V 9.20 4.38 1.62 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 -0.01 0.00 0.00 1.01 0.00 0.00 92 V 8.25 4.22 1.79 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 1.04 0.00 0.00 0.84 0.00 0.00 93 Y 8.37 4.67 0.00 3.09 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 94 D 7.70 5.01 0.00 2.78 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 95 G 7.96 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 0.00 0.00 0.00 96 A 8.65 3.97 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 97 D 8.25 4.83 0.00 2.90 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 98 L 7.87 3.94 0.00 1.76 1.83 0.94 1.10 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 99 H 8.30 4.16 0.00 3.28 3.38 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.07 3.93 0.00 2.06 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 0.00 2.39 2.38 0.00 101 V 8.30 3.54 2.23 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 1.04 0.00 0.00 0.96 0.00 0.00 102 A 7.98 3.96 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 0.00 103 S 7.73 4.07 0.00 4.02 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 0.00 104 L 8.00 4.16 0.00 1.61 1.73 0.97 1.10 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 0.00 105 T 8.23 4.24 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 1.28 0.00 0.00 106 G 7.54 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 *108 T 7.15 4.11 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 109 P 0.00 4.17 0.00 2.10 2.02 0.00 3.54 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 110 A 7.90 3.93 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 0.00 111 Q 7.97 3.95 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 112 V 7.72 3.53 2.17 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 1.08 0.00 0.00 0.98 0.00 0.00 113 I 7.50 3.01 1.63 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 0.74 0.48 0.32 0.00 0.00 114 A 7.97 3.96 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 0.00 115 A 8.22 3.95 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 0.00 116 H 8.31 4.52 0.00 3.32 3.46 0.00 5.75 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 0.00 117 T 7.52 4.81 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 1.49 0.00 0.00 118 G 8.05 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 0.00 119 T 6.90 4.56 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 1.07 0.00 0.00 120 P 0.00 4.86 0.00 2.13 2.14 0.00 3.56 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.34 0.00 121 W 9.78 5.09 0.00 3.26 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 9.15 4.13 0.00 0.67 1.14 0.00 2.83 0.00 0.00 2.61 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.00 123 V 8.01 3.90 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 0.71 0.00 0.00 0.89 0.00 0.00 124 G 9.03 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.32 5.12 0.00 3.03 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 0.00 126 C 8.60 5.28 0.00 3.06 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.67 4.02 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 0.00 0.00 0.00 128 F 9.77 3.92 0.00 2.82 2.58 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 0.00 129 A 7.19 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.06 0.00 0.87 0.82 0.00 3.44 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 131 G 8.84 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 0.00 132 F 8.29 4.13 0.00 3.12 3.30 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 0.00 133 A 7.58 5.01 1.03 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 0.00 0.00 134 Y 8.87 4.03 0.00 1.51 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 0.00 0.00 0.00 135 L 8.97 5.06 0.00 1.57 1.79 0.90 0.49 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 0.00 136 V 9.08 4.88 2.21 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 1.20 0.00 0.00 1.05 0.00 0.00 137 D 8.81 4.49 0.00 2.95 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 0.00 138 G 6.73 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 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.75 4.11 0.00 2.72 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 0.00 140 A 8.52 4.08 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 0.00 141 R 7.92 4.00 0.00 2.07 2.01 0.00 3.20 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 142 L 7.68 4.14 0.00 2.00 1.87 1.31 0.82 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 0.00 143 Q 7.93 4.69 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.63 0.00 0.00 0.00 0.00 0.00 2.59 2.28 0.00 144 V 8.17 4.65 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 0.92 0.00 0.00 0.92 0.00 0.00 145 P 0.00 4.76 0.00 2.10 2.09 0.00 3.76 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 1.98 1.99 0.00 146 R 8.37 4.12 0.00 1.86 1.98 0.00 3.40 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 147 R 8.72 4.10 0.00 1.86 1.90 0.00 3.33 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.94 0.00 148 A 8.84 4.20 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 0.00 149 E 7.76 4.78 0.00 1.94 1.84 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 2.21 2.30 0.00 150 P 0.00 4.51 0.00 2.08 2.05 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 151 R 8.65 4.27 0.00 1.98 1.79 0.00 3.07 0.00 0.00 3.12 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 152 T 8.44 3.92 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 1.20 0.00 0.00 153 S 7.73 4.60 0.00 3.78 3.65 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 0.00 154 V 8.61 4.47 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 0.60 0.00 0.00 -0.06 0.00 0.00 155 P 0.00 4.66 0.00 2.06 2.12 0.00 3.58 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 156 A 8.38 4.13 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 0.00 157 G 9.78 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 0.00 158 A 7.85 4.49 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 0.00 159 V 8.73 4.45 1.85 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 0.55 0.00 0.00 0.89 0.00 0.00 160 A 9.08 5.44 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 0.00 0.00 0.00 0.00 0.00 0.00 161 L 9.05 5.13 0.00 1.46 1.42 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 162 A 8.59 4.20 -0.16 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 0.00 163 G 9.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 E 8.44 4.26 0.00 1.88 1.83 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 1.47 1.47 0.00 165 F 7.79 6.06 0.00 2.76 3.10 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 0.00 166 S 8.11 4.94 0.00 2.72 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 0.00 167 G 8.38 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 V 7.42 4.75 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 0.90 0.00 0.00 1.00 0.00 0.00 169 Y 8.96 4.36 0.00 3.01 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 0.00 170 P 0.00 4.40 0.00 2.26 2.26 0.00 4.02 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 171 R 7.64 4.84 0.00 1.69 1.86 0.00 3.43 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 172 Q 8.92 4.49 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 173 S 8.23 4.72 0.00 3.89 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 0.00 174 P 0.00 4.71 0.00 2.14 2.20 0.00 3.42 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.82 0.00 175 G 8.67 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 0.00 176 G 8.86 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 0.00 0.00 0.00 0.00 177 W 7.88 4.80 0.00 3.35 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 0.00 178 Q 9.17 4.42 0.00 2.27 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 179 L 9.61 4.97 0.00 1.61 1.60 0.86 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 180 I 8.83 4.26 1.97 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 1.17 0.90 0.92 0.00 0.00 181 G 7.30 4.27 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 0.00 182 H 7.89 5.26 0.00 3.23 3.31 0.00 5.21 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 0.00 183 T 8.87 4.89 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 1.28 0.00 0.00 184 D 8.47 4.81 0.00 2.70 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 0.00 185 A 7.54 4.07 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 0.00 186 V 7.96 3.89 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 0.82 0.00 0.00 0.93 0.00 0.00 *188 F 8.20 4.54 0.00 3.04 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 0.00 189 D 8.13 4.39 0.00 2.55 2.29 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 0.00 190 V 8.29 3.43 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 0.77 0.00 0.00 1.04 0.00 0.00 191 N 8.12 4.58 0.00 2.81 2.86 0.00 0.00 6.95 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 R 7.51 4.15 0.00 1.67 1.83 0.00 3.20 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 193 D 8.75 4.39 0.00 2.68 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 0.00 194 K 7.57 4.40 0.00 1.68 1.72 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.40 7.81 195 P 0.00 4.73 0.00 2.02 1.61 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.94 0.00 196 A 7.71 4.80 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 0.00 197 L 8.74 4.02 0.00 1.73 1.70 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 198 L 7.78 4.61 0.00 1.58 1.50 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 199 T 8.17 4.64 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 1.22 0.00 0.00 200 P 0.00 4.25 0.00 2.06 2.25 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 201 G 8.67 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 *203 W 7.65 4.69 0.00 3.49 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 9.49 4.84 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 0.34 0.00 0.00 0.84 0.00 0.00 205 Q 8.76 5.00 0.00 2.23 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 206 F 8.89 5.28 0.00 3.37 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 0.00 207 R 9.26 4.93 0.00 1.90 2.00 0.00 3.13 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 208 A 8.98 5.05 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 0.00 209 V 8.67 4.41 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 0.74 0.00 0.00 0.98 0.00 0.00 210 G 7.92 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 * Residues marked with a * may have inaccurate shift predictions.