NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3161 8.3044 120.3277 54.3168 34.0713 174.6371 2 D 4.0595 8.1698 115.6456 53.2713 39.0361 170.6867 3 K 3.9871 9.1191 126.6943 59.2656 33.8018 176.6694 4 N 5.1322 7.9909 115.3455 50.7982 36.5359 173.0246 5 E 5.1584 7.5082 129.5580 55.8362 32.5720 178.1019 6 L 4.2351 7.5518 118.3200 56.3920 41.5902 179.3136 7 V 3.6079 7.7000 118.5839 66.0233 31.8407 177.5049 8 Q 3.9637 8.1942 117.2530 59.0101 28.4365 179.4275 9 K 3.8872 8.0827 120.2125 59.5625 32.0980 178.5049 10 A 4.0570 7.9229 121.0416 55.4872 18.0593 179.7749 11 K 3.9126 8.4221 116.9377 59.6263 32.0857 179.2611 12 L 3.9120 7.8821 119.3347 58.1408 41.9753 178.7137 13 A 4.1487 8.0906 120.8616 54.9264 18.3613 179.1789 14 E 4.2035 7.9281 117.6241 59.3123 29.5516 178.6006 15 Q 4.1912 8.0540 113.6850 57.1772 28.6514 177.0800 16 A 4.4412 7.8483 120.7830 51.8709 19.9147 178.3170 17 E 2.9328 8.4597 118.6040 58.2605 29.7409 175.1199 18 R 3.9159 7.3520 116.9154 56.7293 28.9541 176.5330 19 Y 4.6335 7.8294 121.9231 60.3362 38.0821 177.4732 20 D 4.3580 8.0191 119.9205 57.3018 41.0903 178.1803 21 D 4.3627 8.0227 118.9455 57.6153 40.7992 178.0872 22 M 4.0721 7.8906 118.7595 58.3436 32.3542 177.7439 23 A 4.0781 8.7624 120.8820 55.4130 18.5578 179.6258 24 A 3.9138 8.1864 118.8313 55.7438 18.4597 179.5287 25 C 4.0097 8.3933 115.5892 63.2712 28.0251 176.5775 26 M 4.0222 8.1970 120.1857 57.9026 31.7209 178.1506 27 K 3.6952 7.9508 119.9662 59.9150 32.0350 178.2563 28 S 4.0371 7.6534 111.1687 61.4271 62.2618 176.2225 29 V 3.6539 6.9586 119.2310 66.2015 31.4657 177.4090 30 T 3.7560 8.1160 112.1272 64.6780 67.9367 175.0868 31 E 2.7659 7.7711 119.1020 57.2879 29.0053 175.0645 32 Q 4.3574 7.6200 123.9744 56.2349 30.5791 174.7905 33 G 3.8942 8.8192 107.4888 44.2482 0.0000 173.4539 34 A 4.2159 8.6630 128.9557 52.8477 17.9058 174.6075 35 E 3.6649 8.7922 116.0161 56.6419 27.1543 172.9128 36 L 4.9149 8.1042 122.9482 52.3992 43.5263 177.1950 37 S 4.0479 8.7950 117.1454 59.1982 63.4040 175.0269 38 N 3.7877 9.0775 126.1198 56.5260 38.4726 176.8232 39 E 4.0928 8.0155 120.8438 59.2884 29.8673 178.2865 40 E 3.9798 8.2362 118.0885 59.7488 29.3969 179.1991 41 R 4.0765 8.6612 118.0537 59.4824 30.1742 177.6917 42 N 5.1242 8.5044 118.5758 55.6937 39.0837 176.5357 43 L 3.9841 8.0062 119.8885 58.1415 41.7945 179.2454 44 L 4.0671 7.8505 119.2713 58.4459 41.8197 179.0740 45 S 4.3671 8.4201 115.3614 61.6772 62.7895 177.0788 46 V 3.7136 7.9009 120.9419 64.6351 31.7454 177.6972 47 A 3.8038 8.2086 122.7428 55.0474 18.2180 179.2128 48 Y 3.8184 8.3477 114.8475 60.9710 37.9618 179.1819 49 K 4.2173 8.0370 119.9567 60.6638 32.5416 178.1730 50 N 4.2569 8.8181 118.1159 56.0615 38.1688 177.2260 51 V 3.3300 8.2686 116.1875 67.1941 31.9340 178.5697 52 V 3.7800 8.4497 119.9407 64.9042 31.3913 178.5932 53 G 3.4679 8.4484 106.6059 47.7087 0.0000 175.7098 54 A 3.9328 9.0390 124.4171 54.6545 18.6064 179.9239 55 R 3.9179 7.9883 116.2655 59.1982 30.2891 179.4460 56 R 3.8449 8.0541 118.6946 59.3446 29.9258 178.2379 57 S 4.0825 8.6976 113.2430 61.7202 62.2565 176.2652 58 S 4.0864 8.0872 117.5041 61.4181 62.6264 176.3747 59 W 4.0774 8.5303 131.2798 60.7824 29.8900 177.8189 60 R 4.0929 8.1980 117.6115 59.3275 29.5892 178.9462 61 V 3.6335 7.5669 118.8849 65.2863 31.1398 178.8134 62 V 3.5159 7.3741 120.4448 63.9995 30.9028 178.2473 63 S 3.6879 7.4048 115.6103 61.5785 62.2773 176.4390 64 S 4.1672 7.6694 114.9299 61.0051 62.9764 176.6081 65 I 3.6890 7.6511 124.8714 63.4802 37.1275 176.8891 66 E 3.5694 8.7504 118.8306 56.1252 29.2011 175.5797 67 Q 2.9996 6.6938 115.6259 58.2481 30.5791 176.0478 *73 E 4.3037 7.7990 123.2097 56.3088 31.0552 177.0756 74 K 3.5833 8.1062 118.6798 59.8660 31.5587 178.0904 75 K 4.0224 8.1105 119.1566 59.2449 31.9514 178.5176 76 Q 4.0750 8.9045 119.3386 59.0641 28.6845 178.0053 77 Q 3.9169 7.7997 120.3405 59.1415 28.8564 178.0294 78 M 4.0111 8.0368 118.7185 58.2450 32.2025 177.9592 79 A 3.9894 7.5601 119.8567 55.2190 18.7337 179.3124 80 R 3.6452 8.2174 117.3968 59.8520 29.8388 178.2913 81 E 4.1653 8.2344 117.9445 59.1199 29.3153 177.8984 82 Y 4.5148 7.7514 119.7436 60.4971 38.8812 177.0216 83 R 3.6898 8.8720 120.7267 59.5525 30.1982 177.8484 84 E 3.9326 8.6824 119.3206 59.5208 29.8794 179.1071 85 K 4.0284 7.9871 118.6727 59.0773 32.0969 178.3734 86 I 4.2342 8.1292 113.4038 63.2637 38.2346 177.2813 87 E 3.9973 8.5037 120.7927 59.7942 29.2351 178.7894 88 T 3.8922 7.9534 115.0826 66.7362 68.3706 176.3967 89 E 4.0888 7.6894 117.8214 59.6825 29.7437 178.1780 90 L 3.9393 8.7665 121.6723 57.7628 42.1243 178.5224 91 R 3.8667 8.7962 118.3729 60.0694 30.2772 178.1548 92 D 4.4144 8.4979 118.5450 57.6336 40.6740 179.4360 93 I 3.8077 8.3748 120.3544 65.0261 37.2421 177.4669 94 C 3.7632 8.2224 117.0431 62.2210 27.9368 175.4849 95 N 4.0037 8.2641 117.2661 56.6764 38.2094 176.7785 96 D 4.2754 7.5609 117.5702 57.3460 41.5526 178.5808 97 V 3.3271 7.9417 119.5145 64.9871 31.7106 178.0988 98 L 3.6966 8.0363 122.9513 58.2206 41.9289 178.0533 99 S 4.0968 8.4348 112.9567 59.9833 62.0271 176.6528 100 L 3.7861 7.9763 120.5145 57.9288 41.7724 178.6976 101 L 3.6373 8.1344 120.5925 58.6201 41.6211 178.7271 102 E 4.0073 8.2647 119.6428 58.1694 30.0421 177.9857 103 K 4.6084 8.0274 118.2550 55.2088 32.9472 177.0780 104 F 4.8060 7.6914 127.6337 58.9482 40.2985 175.6215 105 L 3.9368 7.3631 120.2355 56.3761 42.0900 178.2225 106 I 3.9860 7.9409 114.5011 63.7151 37.5866 175.7852 107 P 4.5577 0.0000 0.0000 58.8128 30.1827 175.1240 108 N 5.3524 7.1056 135.0000 54.8468 40.5756 173.0099 109 A 5.1877 7.1860 121.9231 49.9790 23.1050 174.9216 *112 A 4.4739 8.3521 118.9775 52.4741 19.8097 178.1177 113 E 4.1380 9.2362 120.2736 61.1240 30.4393 178.9095 114 S 3.8755 8.2782 115.7608 61.5995 62.6545 176.6820 115 K 3.8929 8.1162 120.1738 59.6984 31.6063 178.8522 116 V 3.7956 8.1056 118.1384 65.4855 31.6003 177.1542 117 F 4.2769 8.1684 119.7048 61.9754 38.9294 176.2778 118 Y 4.1645 8.0083 115.9068 61.4875 37.8360 178.9684 119 L 3.7919 7.8486 119.5993 57.9362 41.5884 179.5779 120 K 4.1215 8.3743 119.9155 59.4622 32.1934 178.1440 121 M 4.1841 8.4444 119.7935 57.8891 31.9966 178.1521 122 K 4.0446 8.8671 120.0108 59.7779 32.5231 179.0663 123 G 2.5874 7.5424 105.2351 47.3010 0.0000 174.8522 124 D 4.3549 7.7579 123.1169 56.7201 40.7480 177.9556 125 Y 4.1407 7.8535 117.0098 61.8605 37.9983 178.9926 126 Y 4.2169 7.9348 117.2302 60.5981 37.8080 178.3109 127 R 4.0233 7.5092 119.7079 59.6266 30.0771 177.9338 128 Y 4.8309 7.7684 118.1136 60.9003 37.8902 178.8692 129 L 3.9344 8.6047 119.6814 57.7560 41.4185 179.5779 130 A 4.0111 8.5500 121.1276 55.1190 18.4562 179.1337 131 E 3.9775 8.2933 117.3307 59.4604 29.2485 179.8578 132 V 3.0938 6.9648 117.1365 64.7562 31.8477 176.1143 133 A 4.0763 7.4166 119.8408 52.7258 18.3056 175.6529 134 A 4.6192 7.9137 119.8125 52.8489 23.4651 180.1574 135 G 3.9003 7.6584 101.4289 44.1335 0.0000 172.5153 136 D 4.4284 8.9223 117.8568 57.5823 40.7988 178.9832 137 D 4.4748 8.2726 119.0221 57.6190 40.7128 178.3193 138 K 3.7644 8.0507 119.3762 59.8517 32.1179 177.9260 139 K 3.9204 7.9224 118.0924 59.9457 32.0966 178.9983 140 G 3.6611 8.0633 105.0380 47.7482 0.0000 175.6694 141 I 4.0497 7.6646 122.1073 63.9851 37.1033 178.7309 142 V 3.6953 8.2462 120.5503 65.0752 31.2777 177.7927 143 D 4.3508 8.0819 119.5961 56.8327 41.1397 178.3164 144 Q 3.8064 8.0765 118.3794 58.8161 28.6084 178.9919 145 S 3.3574 7.6074 113.8354 61.6594 62.3832 175.1559 146 Q 3.4030 7.8533 121.2211 59.7706 28.7324 178.5577 147 Q 3.6211 8.3496 118.0634 59.3848 28.7749 179.8271 148 A 3.8580 6.9106 119.2981 55.0634 18.6873 179.0992 149 Y 4.0794 7.9468 115.6148 61.0442 37.8293 177.6660 150 Q 4.5662 8.4381 121.4647 59.8663 29.1521 178.8131 151 E 3.9684 8.1906 119.4507 59.1454 29.6470 178.6913 152 A 4.1018 8.5692 121.3633 54.7348 18.2487 179.1146 153 F 4.4566 8.4950 118.0757 62.0417 39.4630 176.8928 154 E 3.8664 8.0998 117.9995 59.3209 29.0754 179.3525 155 I 3.9232 7.5709 118.4878 63.7785 37.1592 178.2687 156 S 4.3055 7.8823 115.1411 60.7523 63.7831 175.6729 157 K 4.0711 7.3754 122.9374 55.7670 30.2637 176.6742 *166 I 3.9754 6.9384 120.0998 60.6034 40.6997 176.5244 167 R 3.9070 7.8628 118.8535 59.8630 29.5472 177.9729 168 L 4.0154 8.1727 119.3501 58.2728 42.0644 178.6903 169 G 3.9031 8.0428 104.5070 48.2326 0.0000 174.2758 170 L 3.9012 8.3987 122.4466 58.0691 41.9367 178.8106 171 A 3.9266 8.3380 120.2361 55.5424 18.2907 179.0063 172 L 3.9541 7.7082 117.5767 58.4935 42.0882 178.7836 173 N 4.3947 8.2232 115.6014 56.3999 38.4006 177.2615 174 F 3.5284 7.8773 120.7590 61.1267 39.5861 176.4507 175 S 4.0780 8.3118 113.3405 61.7694 62.0690 176.7243 176 V 4.1008 8.5509 121.8323 65.0121 30.9729 177.6769 177 F 4.2977 8.7309 120.7814 61.7396 39.1110 176.6409 178 Y 3.7930 7.9659 115.6569 60.2995 38.9791 176.4982 179 Y 4.5520 7.9408 121.1877 57.1090 36.4897 174.2868 *188 A 3.3879 6.9864 125.3630 50.8553 21.7665 178.4780 189 C 3.5213 7.3566 108.5001 60.9445 29.5912 176.1172 190 S 3.9397 7.8418 114.9728 61.4357 61.8777 176.2670 191 L 3.7224 7.3937 120.8115 57.8417 41.1787 178.9000 192 A 3.9656 7.5536 120.6620 54.4804 18.2863 178.9207 193 K 4.2178 8.6013 116.8065 60.7848 32.4994 178.5616 194 T 4.0010 7.9211 114.9806 67.0244 68.1117 175.8100 195 A 4.3591 8.1381 124.9268 54.3085 18.4142 179.1037 196 F 4.3642 8.1649 119.7930 60.9069 39.8498 176.6982 197 D 3.3700 8.1095 118.5423 57.0271 40.6762 178.1785 198 E 3.7917 7.5150 116.4640 59.5838 29.6061 178.7320 199 A 4.2564 7.2066 117.9479 54.5734 18.9787 178.0108 200 I 3.7769 7.1610 117.2197 61.2995 35.0461 174.7267 201 A 4.5387 8.0791 131.0372 53.0254 21.1001 177.4877 *212 D 4.7414 7.6370 117.4599 53.6353 41.9389 181.7585 213 D 4.5170 8.2499 120.0595 56.7385 39.1057 178.9757 214 S 3.9734 8.1151 116.4775 61.4611 62.8917 176.2975 215 T 3.8463 7.9944 117.4613 67.4068 67.9713 175.4012 216 L 3.7934 7.5361 118.6203 58.3928 42.1393 179.2692 217 I 3.8567 7.6085 118.5671 65.1035 37.2772 178.0989 218 M 4.0613 7.9046 118.4935 58.6479 31.8913 178.3208 219 Q 3.9260 8.1183 119.5161 59.4800 29.0901 179.0882 220 L 3.9326 7.7274 119.4571 57.7797 41.7005 179.5565 221 L 4.0334 7.7958 119.1816 58.7322 40.3543 178.9001 222 R 3.4583 8.0986 119.7368 59.3356 30.0637 177.7199 223 D 4.6224 8.3929 119.2457 56.8344 40.9990 178.4501 224 N 3.8170 8.2948 117.1804 56.0945 38.2928 177.4301 225 L 4.3904 7.5682 119.2826 57.8540 41.8510 179.0025 226 T 3.9544 8.2355 116.2375 67.2826 68.1280 175.8429 227 L 3.9564 7.4482 119.9491 57.0567 41.7116 177.2030 228 W 4.3566 8.3648 124.0599 57.1013 29.0182 176.4688 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 3.02 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 4.24 0.00 1.83 1.69 0.96 0.66 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 0.98 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 1.44 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 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 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 2.37 2.39 0.00 0.00 0.00 0.00 0.00 2.35 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 0.85 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 24 A 8.19 3.91 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 25 C 8.39 4.01 0.00 3.22 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 2.18 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 3.70 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 0.95 0.00 0.00 30 T 8.12 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 1.01 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 1.51 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 0.00 0.00 35 E 8.79 3.66 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 1.01 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 8.79 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 8.50 5.12 0.00 3.11 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 1.05 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 1.78 1.71 0.83 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 1.07 0.00 0.00 0.90 0.00 0.00 47 A 8.21 3.80 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 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 7.29 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 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 0.89 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 1.20 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 0.90 0.00 0.00 0.87 0.00 0.00 62 V 7.37 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 0.63 0.00 0.00 0.73 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 2.50 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 2.03 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 1.33 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 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 8.23 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 0.91 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 8.37 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 2.84 0.00 0.00 6.81 7.83 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 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 0.10 0.00 0.00 0.32 0.00 0.00 98 L 8.04 3.70 0.00 1.61 1.55 1.14 -0.66 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 0.91 0.22 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 8.13 3.64 0.00 1.89 1.56 0.57 1.24 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 0.73 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 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.51 0.95 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 1.32 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 *112 A 8.35 4.47 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 1.05 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 2.92 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 1.02 0.69 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 8.44 4.18 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 2.20 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 4.35 0.00 2.49 1.75 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 0.00 125 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 2.91 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 0.00 129 L 8.60 3.93 0.00 1.76 1.66 0.94 0.67 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 1.43 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 0.00 131 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 0.62 0.00 0.00 0.57 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 7.91 4.62 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 0.00 135 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 2.05 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 1.24 1.05 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 0.88 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 0.98 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 0.00 149 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 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 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 1.14 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 0.00 171 A 8.34 3.93 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 0.00 172 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 1.02 0.00 0.00 1.25 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 0.75 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 0.00 189 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 0.14 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 192 A 7.55 3.97 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 0.00 193 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 1.32 0.00 0.00 195 A 8.14 4.36 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 0.00 196 F 8.16 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 1.40 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 0.00 200 I 7.16 3.78 1.78 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.39 0.87 0.00 0.00 201 A 8.08 4.54 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 *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 0.82 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 1.38 0.94 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 2.16 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 1.02 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 0.62 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 4.62 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 8.29 3.82 0.00 2.82 2.74 0.00 0.00 6.96 6.46 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 0.00 225 L 7.57 4.39 0.00 1.74 1.71 1.05 0.97 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 8.24 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 0.61 0.59 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.