NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3163 8.3044 120.3277 54.3166 34.0719 174.6356 2 D 4.0601 8.1693 115.6684 53.2698 39.0362 170.6855 3 K 3.9874 9.1182 126.6920 59.2644 33.8042 176.6689 4 N 5.1318 7.9911 115.3413 50.7990 36.5380 173.0206 5 E 5.1566 7.5081 129.5534 55.8366 32.5780 178.1026 6 L 4.2345 7.5522 118.3224 56.3965 41.5890 179.3157 7 V 3.6077 7.7003 118.5832 66.0237 31.8403 177.5053 8 Q 3.9639 8.1942 117.2531 59.0095 28.4370 179.4286 9 K 3.8872 8.0825 120.2119 59.5633 32.0969 178.5060 10 A 4.0573 7.9223 121.0418 55.4853 18.0594 179.7750 11 K 3.9123 8.4231 116.9420 59.6270 32.0855 179.2617 12 L 3.9126 7.8822 119.3326 58.1402 41.9747 178.7135 13 A 4.1484 8.0912 120.8632 54.9267 18.3608 179.1788 14 E 4.2035 7.9282 117.6247 59.3116 29.5516 178.6000 15 Q 4.1912 8.0535 113.6812 57.1750 28.6502 177.0790 16 A 4.4411 7.8482 120.7810 51.8712 19.9145 178.3215 17 E 2.9333 8.4609 118.6104 58.2608 29.7403 175.1178 18 R 3.9160 7.3529 116.9169 56.7262 28.9566 176.5339 19 Y 4.6332 7.8305 121.9301 60.3416 38.0810 177.4760 20 D 4.3578 8.0192 119.9180 57.3029 41.0890 178.1816 21 D 4.3629 8.0228 118.9452 57.6146 40.7993 178.0863 22 M 4.0725 7.8902 118.7568 58.3427 32.3540 177.7438 23 A 4.0781 8.7625 120.8823 55.4131 18.5575 179.6265 24 A 3.9136 8.1863 118.8311 55.7439 18.4558 179.5270 25 C 4.0084 8.3915 115.5896 63.2741 28.0262 176.5764 26 M 4.0210 8.1976 120.1810 57.8989 31.7215 178.1508 27 K 3.6945 7.9508 119.9666 59.9156 32.0351 178.2589 28 S 4.0372 7.6541 111.1705 61.4252 62.2618 176.2215 29 V 3.6541 6.9587 119.2412 66.2011 31.4658 177.4099 30 T 3.7559 8.1147 112.1232 64.6769 67.9348 175.0832 31 E 2.7654 7.7714 119.1058 57.2881 29.0138 175.0679 32 Q 4.3575 7.6209 123.9796 56.2380 30.5756 174.7951 33 G 3.8947 8.8190 107.4923 44.2439 0.0000 173.4501 34 A 4.2159 8.6624 128.9573 52.8506 17.9060 174.6004 35 E 3.6651 8.7922 116.0204 56.6398 27.1526 172.9118 36 L 4.9143 8.1034 122.9437 52.3971 43.5293 177.1956 37 S 4.0485 8.7966 117.1443 59.2007 63.4037 175.0282 38 N 3.7891 9.0774 126.1194 56.5268 38.4740 176.8231 39 E 4.0929 8.0156 120.8418 59.2888 29.8665 178.2875 40 E 3.9798 8.2359 118.0886 59.7477 29.3969 179.1994 41 R 4.0767 8.6603 118.0520 59.4804 30.1749 177.6914 42 N 5.1240 8.5066 118.5791 55.6913 39.0838 176.5363 43 L 3.9839 8.0054 119.8886 58.1415 41.7947 179.2466 44 L 4.0672 7.8507 119.2731 58.4458 41.8198 179.0738 45 S 4.3673 8.4204 115.3620 61.6769 62.7896 177.0777 46 V 3.7141 7.9015 120.9433 64.6335 31.7465 177.6987 47 A 3.8036 8.2092 122.7419 55.0467 18.2185 179.2121 48 Y 3.8183 8.3478 114.8471 60.9709 37.9624 179.1825 49 K 4.2171 8.0368 119.9555 60.6646 32.5404 178.1727 50 N 4.2567 8.8208 118.1136 56.0646 38.1689 177.2323 51 V 3.3258 8.2694 116.1593 67.1843 31.9387 178.5661 52 V 3.7803 8.4480 119.9577 64.9044 31.3933 178.5942 53 G 3.4680 8.4477 106.6077 47.7072 0.0000 175.7086 54 A 3.9328 9.0406 124.4153 54.6550 18.6057 179.9229 55 R 3.9176 7.9885 116.2622 59.1995 30.2896 179.4456 56 R 3.8445 8.0537 118.6925 59.3462 29.9257 178.2373 57 S 4.0824 8.6979 113.2424 61.7210 62.2565 176.2648 58 S 4.0865 8.0887 117.5044 61.4177 62.6243 176.3769 59 W 4.0770 8.5309 131.2793 60.7799 29.8859 177.8209 60 R 4.0930 8.1981 117.6141 59.3268 29.5890 178.9454 61 V 3.6327 7.5668 118.8862 65.2877 31.1393 178.8132 62 V 3.5160 7.3754 120.4418 63.9973 30.9096 178.2470 63 S 3.6877 7.4044 115.6140 61.5814 62.2777 176.4371 64 S 4.1681 7.6714 114.9336 61.0026 62.9755 176.6134 65 I 3.6886 7.6516 124.8765 63.4742 37.1278 176.8890 66 E 3.5706 8.7496 118.8420 56.1181 29.2012 175.5773 67 Q 2.9995 6.6907 115.6221 58.2479 30.5797 176.0470 *73 E 4.3037 7.7994 123.2064 56.3091 31.0526 177.0755 74 K 3.5837 8.1063 118.6799 59.8660 31.5511 178.0896 75 K 4.0217 8.1108 119.1567 59.2460 31.9511 178.5180 76 Q 4.0737 8.9049 119.3398 59.0653 28.6833 178.0062 77 Q 3.9174 7.8002 120.3447 59.1402 28.8560 178.0293 78 M 4.0108 8.0367 118.7201 58.2450 32.2028 177.9588 79 A 3.9897 7.5609 119.8648 55.2196 18.7331 179.3127 80 R 3.6451 8.2188 117.3994 59.8517 29.8388 178.2909 81 E 4.1650 8.2353 117.9465 59.1204 29.3152 177.8993 82 Y 4.5150 7.7511 119.7462 60.4970 38.8810 177.0242 83 R 3.6899 8.8714 120.7268 59.5503 30.1990 177.8466 84 E 3.9330 8.6812 119.3239 59.5225 29.8775 179.1060 85 K 4.0287 7.9873 118.6716 59.0769 32.0973 178.3742 86 I 4.2339 8.1293 113.4042 63.2641 38.2344 177.2821 87 E 3.9974 8.5035 120.7935 59.7922 29.2359 178.7921 88 T 3.8919 7.9530 115.0821 66.7369 68.3711 176.3993 89 E 4.0891 7.6880 117.8135 59.6787 29.7435 178.1772 90 L 3.9395 8.7651 121.6727 57.7673 42.1252 178.5224 91 R 3.8671 8.7952 118.3725 60.0686 30.2764 178.1540 92 D 4.4143 8.4975 118.5453 57.6344 40.6745 179.4361 93 I 3.8070 8.3760 120.3564 65.0283 37.2416 177.4680 94 C 3.7630 8.2231 117.0442 62.2202 27.9380 175.4870 95 N 4.0041 8.2637 117.2647 56.6750 38.2096 176.7788 96 D 4.2758 7.5612 117.5728 57.3454 41.5524 178.5801 97 V 3.3273 7.9411 119.5135 64.9885 31.7112 178.1031 98 L 3.6965 8.0356 122.9517 58.2171 41.9308 178.0538 99 S 4.0965 8.4327 112.9571 59.9880 62.0275 176.6492 100 L 3.7865 7.9763 120.5086 57.9324 41.7714 178.6982 101 L 3.6372 8.1352 120.5906 58.6193 41.6204 178.7250 102 E 4.0069 8.2644 119.6487 58.1716 30.0411 177.9880 103 K 4.6083 8.0273 118.2539 55.2117 32.9484 177.0788 104 F 4.8055 7.6922 127.6306 58.9471 40.3020 175.6203 105 L 3.9374 7.3646 120.2313 56.3808 42.0902 178.2216 106 I 3.9860 7.9410 114.4893 63.7137 37.5868 175.7839 107 P 4.5578 0.0000 0.0000 58.8103 30.1832 175.1224 108 N 5.3515 7.1053 135.0000 54.8456 40.5731 173.0102 109 A 5.1870 7.1853 121.9189 49.9789 23.1074 174.9224 *112 A 4.4737 8.3536 118.9816 52.4742 19.8085 178.1190 113 E 4.1383 9.2359 120.2813 61.1185 30.4411 178.9085 114 S 3.8757 8.2789 115.7586 61.6009 62.6537 176.6815 115 K 3.8922 8.1160 120.1724 59.6973 31.6061 178.8513 116 V 3.7961 8.1055 118.1375 65.4835 31.6010 177.1522 117 F 4.2768 8.1692 119.7025 61.9779 38.9282 176.2797 118 Y 4.1642 8.0088 115.9039 61.4867 37.8365 178.9694 119 L 3.7903 7.8483 119.5975 57.9345 41.5868 179.5748 120 K 4.1217 8.3741 119.9197 59.4599 32.1935 178.1433 121 M 4.1838 8.4452 119.7925 57.8892 31.9972 178.1526 122 K 4.0442 8.8676 120.0134 59.7784 32.5238 179.0658 123 G 2.5878 7.5425 105.2308 47.2941 0.0000 174.8602 124 D 4.3552 7.7553 123.1195 56.7243 40.7494 177.9549 125 Y 4.1404 7.8522 117.0158 61.8585 37.9959 178.9905 126 Y 4.2167 7.9348 117.2325 60.5984 37.8077 178.3101 127 R 4.0237 7.5091 119.7041 59.6264 30.0770 177.9349 128 Y 4.8306 7.7686 118.1129 60.9004 37.8898 178.8690 129 L 3.9346 8.6047 119.6821 57.7545 41.4183 179.5775 130 A 4.0112 8.5507 121.1315 55.1200 18.4567 179.1335 131 E 3.9777 8.2945 117.3318 59.4601 29.2484 179.8584 132 V 3.0940 6.9650 117.1375 64.7569 31.8479 176.1143 133 A 4.0770 7.4181 119.8404 52.7268 18.3075 175.6554 134 A 4.6194 7.9158 119.8124 52.8501 23.4645 180.1487 135 G 3.9003 7.6588 101.4299 44.1344 0.0000 172.5157 136 D 4.4283 8.9223 117.8567 57.5835 40.7974 178.9837 137 D 4.4744 8.2727 119.0210 57.6159 40.7128 178.3208 138 K 3.7648 8.0507 119.3826 59.8515 32.1176 177.9279 139 K 3.9206 7.9205 118.0959 59.9448 32.0957 178.9970 140 G 3.6613 8.0634 105.0384 47.7464 0.0000 175.6698 141 I 4.0497 7.6640 122.1105 63.9859 37.1038 178.7296 142 V 3.6962 8.2461 120.5497 65.0766 31.2772 177.7949 143 D 4.3507 8.0827 119.5972 56.8316 41.1405 178.3156 144 Q 3.8068 8.0776 118.3824 58.8133 28.6075 178.9900 145 S 3.3573 7.6069 113.8321 61.6612 62.3841 175.1555 146 Q 3.4025 7.8543 121.2125 59.7713 28.7323 178.5592 147 Q 3.6209 8.3508 118.0630 59.3853 28.7761 179.8284 148 A 3.8582 6.9105 119.2989 55.0637 18.6874 179.0984 149 Y 4.0793 7.9469 115.6161 61.0423 37.8294 177.6658 150 Q 4.5665 8.4373 121.4611 59.8667 29.1546 178.8145 151 E 3.9683 8.1908 119.4515 59.1453 29.6464 178.6906 152 A 4.1025 8.5719 121.3602 54.7330 18.2495 179.1158 153 F 4.4569 8.4946 118.0778 62.0399 39.4610 176.8921 154 E 3.8662 8.0994 118.0004 59.3234 29.0756 179.3551 155 I 3.9222 7.5713 118.4881 63.7827 37.1585 178.2706 156 S 4.3052 7.8832 115.1404 60.7539 63.7818 175.6696 157 K 4.0711 7.3757 122.9341 55.7667 30.2661 176.6730 *166 I 3.9753 6.9372 120.0968 60.6016 40.6992 176.5233 167 R 3.9069 7.8630 118.8580 59.8631 29.5480 177.9731 168 L 4.0157 8.1723 119.3524 58.2731 42.0649 178.6904 169 G 3.9019 8.0429 104.5079 48.2317 0.0000 174.2761 170 L 3.9012 8.3984 122.4434 58.0692 41.9370 178.8097 171 A 3.9265 8.3387 120.2373 55.5408 18.2898 179.0086 172 L 3.9540 7.7081 117.5808 58.4944 42.0889 178.7854 173 N 4.3946 8.2210 115.6021 56.3979 38.3995 177.2599 174 F 3.5276 7.8767 120.7588 61.1280 39.5872 176.4495 175 S 4.0782 8.3120 113.3407 61.7702 62.0696 176.7251 176 V 4.1009 8.5503 121.8312 65.0118 30.9731 177.6768 177 F 4.2990 8.7301 120.7804 61.7398 39.1114 176.6409 178 Y 3.7934 7.9664 115.6595 60.3005 38.9792 176.4987 179 Y 4.5524 7.9398 121.1826 57.1096 36.4913 174.2873 *188 A 3.3882 6.9866 125.3591 50.8581 21.7653 178.4769 189 C 3.5220 7.3574 108.5031 60.9426 29.5919 176.1166 190 S 3.9398 7.8414 114.9689 61.4371 61.8776 176.2658 191 L 3.7221 7.3932 120.8118 57.8422 41.1790 178.9037 192 A 3.9653 7.5529 120.6586 54.4804 18.2873 178.9210 193 K 4.2176 8.6003 116.8122 60.7829 32.4995 178.5628 194 T 4.0026 7.9202 114.9797 67.0255 68.1132 175.8139 195 A 4.3596 8.1370 124.8878 54.3047 18.4111 179.1025 196 F 4.3643 8.1652 119.7951 60.9071 39.8490 176.6967 197 D 3.3700 8.1101 118.5443 57.0284 40.6753 178.1805 198 E 3.7915 7.5158 116.4645 59.5845 29.6064 178.7327 199 A 4.2565 7.2068 117.9486 54.5729 18.9775 178.0090 200 I 3.7766 7.1618 117.2186 61.3028 35.0474 174.7282 201 A 4.5404 8.0796 131.0656 53.0262 21.0958 177.4866 *212 D 4.7412 7.6361 117.4573 53.6337 41.9384 181.7580 213 D 4.5172 8.2498 120.0586 56.7401 39.1045 178.9770 214 S 3.9736 8.1158 116.4799 61.4630 62.8930 176.3011 215 T 3.8461 7.9921 117.4591 67.4034 67.9718 175.3990 216 L 3.7948 7.5352 118.6279 58.3947 42.1407 179.2695 217 I 3.8566 7.6068 118.5650 65.1032 37.2762 178.0975 218 M 4.0613 7.9043 118.4949 58.6485 31.8913 178.3210 219 Q 3.9260 8.1170 119.5136 59.4798 29.0920 179.0865 220 L 3.9326 7.7263 119.4535 57.7816 41.7005 179.5586 221 L 4.0350 7.7958 119.1793 58.7302 40.3553 178.9035 222 R 3.4579 8.0993 119.7371 59.3353 30.0653 177.7220 223 D 4.6251 8.3919 119.2483 56.8337 40.9989 178.4467 224 N 3.8171 8.2971 117.1822 56.0940 38.2923 177.4290 225 L 4.3921 7.5668 119.2834 57.8512 41.8520 179.0025 226 T 3.9546 8.2332 116.2404 67.2826 68.1284 175.8428 227 L 3.9557 7.4499 119.9458 57.0593 41.7104 177.2042 228 W 4.3565 8.3647 124.0625 57.1017 29.0180 176.4685 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 4.32 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 2 D 8.17 4.06 0.00 2.81 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 3 K 9.12 3.99 0.00 1.83 1.81 0.00 1.78 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.48 7.81 4 N 7.99 5.13 0.00 2.74 2.79 0.00 0.00 6.70 7.66 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 5 E 7.51 5.16 0.00 2.06 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 0.00 2.13 2.13 0.00 6 L 7.55 4.23 0.00 1.83 1.69 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.70 3.61 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.01 0.00 0.00 8 Q 8.19 3.96 0.00 2.34 2.18 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 2.47 2.52 0.00 9 K 8.08 3.89 0.00 2.07 1.80 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.60 7.81 10 A 7.92 4.06 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.42 3.91 0.00 2.09 1.89 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.49 1.48 7.81 12 L 7.88 3.91 0.00 1.79 1.89 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.09 4.15 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.93 4.20 0.00 2.34 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 2.45 2.60 0.00 15 Q 8.05 4.19 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.11 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 16 A 7.85 4.44 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 17 E 8.46 2.93 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.28 0.00 18 R 7.35 3.92 0.00 1.81 1.80 0.00 3.25 0.00 0.00 3.10 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 19 Y 7.83 4.63 0.00 3.01 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.02 4.36 0.00 2.67 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 21 D 8.02 4.36 0.00 2.89 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 22 M 7.89 4.07 0.00 2.38 2.39 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.69 0.00 23 A 8.76 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.19 3.91 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 25 C 8.39 4.01 0.00 3.19 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 26 M 8.20 4.02 0.00 2.08 2.38 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.88 0.00 27 K 7.95 3.69 0.00 1.95 2.02 0.00 1.82 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.43 7.81 28 S 7.65 4.04 0.00 3.93 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 29 V 6.96 3.65 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 0.83 0.00 0.00 1.00 0.00 0.00 30 T 8.11 3.76 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 31 E 7.77 2.77 0.00 1.95 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 2.43 2.23 0.00 32 Q 7.62 4.36 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 33 G 8.82 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 34 A 8.66 4.22 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 35 E 8.79 3.67 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 36 L 8.10 4.91 0.00 1.73 1.74 0.96 0.87 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 37 S 8.80 4.05 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 9.08 3.79 0.00 2.74 2.94 0.00 0.00 7.03 7.66 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 39 E 8.02 4.09 0.00 2.01 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 2.34 2.38 0.00 40 E 8.24 3.98 0.00 2.22 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 0.00 2.44 2.42 0.00 41 R 8.66 4.08 0.00 2.15 2.30 0.00 3.43 0.00 0.00 3.59 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.09 0.00 42 N 8.51 5.12 0.00 3.10 2.94 0.00 0.00 7.10 6.21 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 43 L 8.01 3.98 0.00 1.96 1.81 0.99 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.85 4.07 0.00 1.77 1.71 0.79 1.16 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 45 S 8.42 4.37 0.00 4.13 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 46 V 7.90 3.71 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.84 0.00 0.00 47 A 8.21 3.80 1.52 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 0.00 0.00 0.00 48 Y 8.35 3.82 0.00 3.42 3.25 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 49 K 8.04 4.22 0.00 2.02 2.32 0.00 1.34 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.49 7.81 50 N 8.82 4.26 0.00 2.73 2.77 0.00 0.00 6.58 7.30 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 51 V 8.27 3.33 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 0.94 0.00 0.00 0.98 0.00 0.00 52 V 8.45 3.78 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 1.11 0.00 0.00 1.04 0.00 0.00 53 G 8.45 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 9.04 3.93 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 55 R 7.99 3.92 0.00 2.01 2.02 0.00 3.20 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 56 R 8.05 3.84 0.00 2.07 1.79 0.00 2.21 0.00 0.00 2.55 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.38 0.00 57 S 8.70 4.08 0.00 3.88 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.09 4.09 0.00 4.01 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.53 4.08 0.00 3.48 3.34 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 60 R 8.20 4.09 0.00 2.31 2.03 0.00 3.25 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.99 0.00 61 V 7.57 3.63 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 0.88 0.00 0.00 0.87 0.00 0.00 62 V 7.38 3.52 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 0.64 0.00 0.00 0.74 0.00 0.00 63 S 7.40 3.69 0.00 3.58 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.67 4.17 0.00 4.03 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 65 I 7.65 3.69 1.94 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 1.37 0.73 0.89 0.00 0.00 66 E 8.75 3.57 0.00 1.94 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 2.27 2.28 0.00 67 Q 6.69 3.00 0.00 2.30 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.31 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 *73 E 7.80 4.30 0.00 2.01 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 2.27 2.25 0.00 74 K 8.11 3.58 0.00 1.85 1.83 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.53 7.81 75 K 8.11 4.02 0.00 1.85 1.79 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 76 Q 8.90 4.07 0.00 2.24 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.56 0.00 0.00 0.00 0.00 0.00 2.65 2.35 0.00 77 Q 7.80 3.92 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 78 M 8.04 4.01 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 79 A 7.56 3.99 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 80 R 8.22 3.65 0.00 1.86 1.96 0.00 3.11 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 81 E 8.24 4.17 0.00 2.26 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 2.32 2.33 0.00 82 Y 7.75 4.51 0.00 3.04 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 83 R 8.87 3.69 0.00 1.76 1.97 0.00 3.38 0.00 0.00 2.68 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.98 0.00 84 E 8.68 3.93 0.00 2.20 2.27 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 2.37 2.42 0.00 85 K 7.99 4.03 0.00 2.01 2.26 0.00 1.72 0.00 0.00 1.95 0.00 0.00 3.31 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.53 7.81 86 I 8.13 4.23 1.96 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.85 0.90 0.00 0.00 87 E 8.50 4.00 0.00 2.51 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 0.00 2.50 2.55 0.00 88 T 7.95 3.89 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 1.24 0.00 0.00 89 E 7.69 4.09 0.00 2.24 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 2.44 2.36 0.00 90 L 8.77 3.94 0.00 1.84 1.95 0.88 0.80 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 91 R 8.80 3.87 0.00 2.12 2.04 0.00 3.19 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 1.62 1.87 0.00 92 D 8.50 4.41 0.00 2.94 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 93 I 8.38 3.81 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.91 0.85 0.00 0.00 94 C 8.22 3.76 0.00 2.91 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 95 N 8.26 4.00 0.00 2.87 2.83 0.00 0.00 6.81 7.82 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 96 D 7.56 4.28 0.00 3.00 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 97 V 7.94 3.33 1.13 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 0.05 0.00 0.00 0.33 0.00 0.00 98 L 8.04 3.70 0.00 1.61 1.55 1.17 -0.73 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 99 S 8.43 4.10 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.98 3.79 0.00 1.81 1.41 0.87 0.21 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 0.00 101 L 8.14 3.64 0.00 1.89 1.56 0.55 1.22 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 0.00 102 E 8.26 4.01 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.68 0.00 103 K 8.03 4.61 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.36 7.81 104 F 7.69 4.81 0.00 3.17 2.82 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 0.00 105 L 7.36 3.94 0.00 1.31 0.59 0.63 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.94 3.99 1.91 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 1.53 0.51 0.96 0.00 0.00 107 P 0.00 4.56 0.00 2.17 2.10 0.00 3.97 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 1.93 2.07 0.00 108 N 7.11 5.35 0.00 3.05 2.96 0.00 0.00 6.93 7.35 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 0.00 109 A 7.19 5.19 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 *112 A 8.35 4.47 1.02 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 0.00 113 E 9.24 4.14 0.00 2.14 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 0.00 2.35 2.31 0.00 114 S 8.28 3.88 0.00 3.72 3.39 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 0.00 115 K 8.12 3.89 0.00 1.80 1.93 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.57 7.81 116 V 8.11 3.80 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 1.15 0.00 0.00 0.98 0.00 0.00 117 F 8.17 4.28 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 8.01 4.16 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 0.00 119 L 7.85 3.79 0.00 2.01 1.79 1.01 0.62 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 0.00 120 K 8.37 4.12 0.00 2.00 2.29 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.40 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.76 1.56 7.81 121 M 8.45 4.18 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.65 0.00 122 K 8.87 4.04 0.00 1.82 1.88 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.62 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.27 1.52 7.81 123 G 7.54 2.59 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 0.00 124 D 7.76 4.36 0.00 2.49 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 7.85 4.14 0.00 3.00 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 0.00 126 Y 7.93 4.22 0.00 2.67 3.03 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 0.00 127 R 7.51 4.02 0.00 1.86 1.90 0.00 3.62 0.00 0.00 3.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.16 0.00 128 Y 7.77 4.83 0.00 3.31 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.60 3.93 0.00 1.76 1.66 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.55 4.01 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.29 3.98 0.00 1.77 1.77 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 2.36 2.73 0.00 132 V 6.96 3.09 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 0.65 0.00 0.00 0.55 0.00 0.00 133 A 7.42 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 0.00 134 A 7.92 4.62 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.66 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.92 4.43 0.00 2.73 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 0.00 137 D 8.27 4.47 0.00 2.81 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.05 3.76 0.00 2.03 1.85 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.51 7.81 139 K 7.92 3.92 0.00 1.92 1.84 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.50 7.81 140 G 8.06 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.66 4.05 2.04 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 1.60 1.25 1.08 0.00 0.00 142 V 8.25 3.70 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 0.91 0.00 0.00 1.00 0.00 0.00 143 D 8.08 4.35 0.00 3.05 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 0.00 144 Q 8.08 3.81 0.00 2.35 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 2.48 2.75 0.00 145 S 7.61 3.36 0.00 3.78 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 0.00 146 Q 7.85 3.40 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 147 Q 8.35 3.62 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 148 A 6.91 3.86 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 0.00 149 Y 7.95 4.08 0.00 2.13 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 0.00 150 Q 8.44 4.57 0.00 2.31 2.24 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 2.61 2.90 0.00 151 E 8.19 3.97 0.00 2.45 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 152 A 8.57 4.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 F 8.49 4.46 0.00 3.37 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 0.00 154 E 8.10 3.87 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 155 I 7.57 3.92 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.68 0.92 0.00 0.00 156 S 7.88 4.31 0.00 4.10 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.38 4.07 0.00 1.67 1.90 0.00 1.61 0.00 0.00 1.42 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.30 7.81 *166 I 6.94 3.98 1.75 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 1.27 1.36 0.87 0.00 0.00 167 R 7.86 3.91 0.00 1.94 1.95 0.00 3.28 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 168 L 8.17 4.02 0.00 1.79 1.63 0.96 1.14 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 0.00 169 G 8.04 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.40 3.90 0.00 1.80 1.98 0.96 1.11 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 0.00 171 A 8.34 3.93 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 0.00 172 L 7.71 3.95 0.00 1.85 1.92 1.00 0.68 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 0.00 173 N 8.22 4.39 0.00 2.86 3.01 0.00 0.00 6.79 7.42 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 0.00 174 F 7.88 3.53 0.00 2.55 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 0.00 175 S 8.31 4.08 0.00 3.87 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 0.00 176 V 8.55 4.10 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 1.06 0.00 0.00 1.24 0.00 0.00 177 F 8.73 4.30 0.00 3.44 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Y 7.97 3.79 0.00 2.88 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 0.00 179 Y 7.94 4.55 0.00 2.76 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *188 A 6.99 3.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 C 7.36 3.52 0.00 3.00 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 0.00 190 S 7.84 3.94 0.00 3.74 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 7.39 3.72 0.00 1.20 1.06 0.11 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 192 A 7.55 3.97 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 0.00 193 K 8.60 4.22 0.00 1.88 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.64 1.91 7.81 194 T 7.92 4.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 195 A 8.14 4.36 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 0.00 196 F 8.17 4.36 0.00 3.19 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 D 8.11 3.37 0.00 2.69 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 0.00 198 E 7.52 3.79 0.00 1.95 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 2.30 2.45 0.00 199 A 7.21 4.26 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 0.00 200 I 7.16 3.78 1.78 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.39 0.87 0.00 0.00 201 A 8.08 4.54 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 *212 D 7.64 4.74 0.00 2.64 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 0.00 213 D 8.25 4.52 0.00 2.92 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 8.12 3.97 0.00 3.89 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 0.00 215 T 7.99 3.85 4.35 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 1.22 0.00 0.00 216 L 7.54 3.79 0.00 1.66 1.71 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 217 I 7.61 3.86 1.99 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 1.53 1.39 0.96 0.00 0.00 218 M 7.90 4.06 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.62 0.00 219 Q 8.12 3.93 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 220 L 7.73 3.93 0.00 2.13 1.69 0.93 0.43 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 0.00 221 L 7.80 4.03 0.00 1.87 1.98 1.06 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 222 R 8.10 3.46 0.00 1.70 2.12 0.00 3.06 0.00 0.00 3.04 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 223 D 8.39 4.63 0.00 2.84 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 0.00 224 N 8.30 3.82 0.00 2.82 2.74 0.00 0.00 6.96 6.47 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 0.00 225 L 7.57 4.39 0.00 1.74 1.71 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 226 T 8.23 3.95 4.35 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 1.14 0.00 0.00 227 L 7.45 3.96 0.00 1.10 1.29 0.62 0.62 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 0.00 228 W 8.36 4.36 0.00 3.21 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 * Residues marked with a * may have inaccurate shift predictions.