NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.4960 8.3193 115.4224 58.0317 64.2939 174.2616 1 L 3.9255 7.7844 120.4537 54.5582 41.3596 175.0345 2 Y 5.1127 8.7150 122.2705 55.2558 41.7209 176.1399 3 N 4.8563 10.0403 118.1885 53.6643 40.8248 174.0755 4 Y 5.4213 8.8322 117.2136 56.0955 41.5910 175.1205 5 V 4.5400 8.9136 122.3374 61.2463 34.4028 174.0707 6 L 5.2173 8.6010 128.7112 53.6512 43.1845 176.4233 7 F 5.1510 9.3208 121.2266 55.7724 42.8483 174.5219 8 D 4.9903 8.8711 122.1996 53.4089 42.7273 175.1477 9 L 4.4725 8.6033 121.0890 56.5106 43.2704 175.2401 10 D 4.6886 7.8643 119.1034 55.7719 41.5381 177.3434 11 G 4.6645 10.0231 112.5996 45.9128 0.0000 174.2720 12 T 4.3529 8.1946 113.8035 64.9572 71.1558 175.7095 13 L 4.5785 8.6431 120.7239 55.6186 43.0400 176.8546 14 T 4.6836 7.7598 107.1322 59.6513 71.1636 172.6901 15 D 4.5768 8.2808 124.9666 53.2341 39.8718 176.1501 16 S 4.9262 8.6433 115.9840 56.8101 64.1630 176.2183 17 A 3.8380 8.0012 125.3090 55.7992 17.9392 179.5411 18 E 3.9750 8.4371 117.0744 59.7648 29.7003 179.2391 19 G 4.2779 8.1282 106.7548 47.3785 0.0000 175.7418 20 I 3.8682 7.9309 122.3972 64.4710 37.1449 178.7025 21 T 3.8980 8.4694 111.0166 64.7015 68.4675 176.7651 22 K 3.8705 8.1295 121.4261 59.2414 32.0378 179.5506 23 S 3.9756 7.9521 115.6229 61.2902 62.6242 176.9075 24 V 3.8426 7.9119 121.0915 65.8885 31.2035 177.9896 25 K 3.8897 8.2106 119.6823 59.6343 31.7765 178.0557 26 Y 3.8719 7.8488 118.9624 60.5826 39.0671 177.8411 27 S 4.1433 8.2255 113.9973 61.4488 62.6311 176.1133 28 L 4.2764 8.5548 122.0522 57.9938 41.3440 179.2753 29 N 4.6958 8.2086 117.6442 55.3666 38.1684 177.1937 30 K 3.7462 7.2292 118.0899 57.7097 31.6747 178.1208 31 F 4.6906 8.0695 117.9242 56.3843 38.9648 175.6908 32 D 4.5584 7.6142 116.4487 55.2833 38.4590 173.3883 33 I 4.3240 7.2318 121.3345 60.1130 37.9121 175.4498 34 Q 4.6648 8.4746 124.3696 54.5325 30.4800 175.5047 35 V 4.5059 7.9220 112.7477 59.3288 34.9766 175.4237 36 E 4.1621 9.1639 123.8355 58.7214 29.6846 176.8140 37 D 4.8165 8.0603 119.0005 50.3726 42.7911 175.8450 38 L 3.9093 8.8698 121.9653 58.2527 42.0891 179.3682 39 S 3.9600 8.6230 112.0335 60.6231 62.1472 175.7416 40 S 4.3892 8.2198 112.5785 59.6654 63.1071 174.4765 41 L 4.7242 8.7193 122.2757 54.6812 41.5973 177.9019 42 N 4.3356 8.2069 119.7486 56.1071 38.5532 177.3327 43 K 4.1303 7.9461 115.8619 59.1122 32.5922 177.5962 44 F 3.9449 7.9601 117.3698 58.4962 39.0862 175.5628 45 V 3.7550 7.9815 122.1016 64.7055 30.4954 173.4994 46 G 3.8314 8.5831 119.6112 45.3700 0.0000 171.8843 47 P 4.1409 0.0000 0.0000 60.2375 32.4485 174.8575 48 P 4.2196 0.0000 0.0000 62.4583 32.7527 177.4269 49 L 3.8579 8.4698 122.3350 57.8209 41.3748 179.5467 50 K 4.0118 8.0670 117.9960 59.9936 32.1793 178.1198 51 T 3.9243 7.8073 107.8015 65.0690 68.6664 175.9561 52 S 3.9330 7.5978 117.3949 61.0132 62.8538 177.4051 53 F 4.8806 8.3738 117.7709 58.2996 38.2147 176.8104 *55 E 3.9610 8.0539 120.6947 56.3426 30.7650 176.4405 56 Y 4.2217 7.6489 113.8671 59.4677 38.3128 175.7994 57 Y 4.3451 7.6286 115.3317 56.4340 39.7450 175.0797 58 N 4.1666 8.3198 114.4961 53.9238 36.4678 174.5252 59 F 4.7094 7.4045 114.2096 57.6067 39.5778 175.5968 60 D 4.7837 8.3751 123.4976 52.0276 42.4201 176.6073 61 E 3.9003 8.7386 119.0252 59.9466 29.3628 178.4926 62 E 3.9371 8.1026 116.6015 59.8767 29.6841 179.0739 63 T 3.6851 9.1165 117.0798 66.0679 68.3415 176.6967 64 A 3.9904 8.2564 123.0555 55.3635 18.4904 179.8481 65 T 3.7864 7.7569 114.4287 66.5632 68.4880 177.1936 66 V 3.3174 7.4257 119.6289 65.7872 31.5849 177.9351 67 A 4.1429 7.8062 120.5104 55.2542 18.0175 179.7005 68 I 3.8790 7.8020 118.5067 64.6330 37.1408 178.4111 69 D 4.4521 7.8572 119.3500 57.5300 40.5180 178.4398 70 Y 5.3381 7.7000 118.5107 60.8822 37.8269 177.6608 71 Y 4.6730 8.4703 120.5339 61.3601 38.8403 178.8024 72 R 4.2610 8.7662 118.6445 59.2698 30.1350 178.6008 73 D 4.4206 8.3446 119.0732 57.4658 40.7510 178.0663 74 Y 3.7843 7.5988 117.9808 59.7660 38.6394 177.2728 75 F 3.7030 8.4173 122.2510 60.9824 39.2826 177.2385 76 K 3.3495 8.0495 117.0056 59.0622 32.2328 177.8266 77 A 4.5773 7.0095 119.3984 51.8690 20.2284 176.9254 78 K 4.2348 7.5528 114.5987 58.1273 34.9466 179.8850 79 G 3.3989 6.9160 107.7846 45.7482 0.0000 174.8854 *81 F 4.6904 8.0890 119.4148 56.9718 41.3493 176.1859 82 E 4.4021 7.4071 121.8883 54.8293 27.7542 174.2004 83 N 5.4012 7.7452 119.7953 52.5225 43.9919 172.8274 84 K 4.5756 8.2072 117.9309 55.0923 37.1541 175.3275 85 V 4.0918 7.7040 123.0523 61.7795 32.6586 175.3628 86 Y 4.2515 8.3871 125.4758 57.8146 38.9544 175.6886 87 D 4.3424 8.7094 123.1252 56.0496 41.5978 177.0095 88 G 4.0254 8.8892 111.2270 46.1458 0.0000 175.6994 89 I 3.5958 7.6316 120.6251 64.5235 37.0049 177.8468 90 E 3.6529 8.1427 119.2807 59.0798 29.4167 178.3870 91 A 3.9278 7.9073 120.3257 54.9815 18.3710 179.0459 92 L 3.9072 7.9556 118.8397 58.4166 42.1951 179.0950 93 L 3.6788 7.7677 118.9768 57.6758 41.4303 179.5415 94 S 4.0273 7.7432 112.9806 61.4604 62.3916 175.9194 95 S 4.2136 8.1946 115.8735 61.6392 62.2114 176.2153 96 L 4.2890 8.2490 121.6578 57.9911 41.5433 179.7622 97 K 4.3260 8.2374 118.3374 59.1856 31.6739 179.0395 98 D 4.3265 7.9105 118.0422 57.6092 41.3039 177.6933 99 Y 3.9231 7.9808 115.9244 59.3354 37.8826 177.2469 100 G 3.9969 7.6927 105.6703 44.6842 0.0000 174.0382 101 F 4.5080 7.7598 118.3230 58.0180 39.9970 174.3839 102 H 4.8184 9.5524 119.7722 54.3754 30.5981 173.8652 103 L 5.5510 8.6591 123.1845 53.3782 44.1413 175.6824 104 V 5.1976 9.3234 122.1055 61.3761 35.7442 173.8973 105 V 4.7598 8.7052 126.4746 61.3220 33.4932 174.3190 106 A 5.1848 9.3596 129.6221 50.5656 21.5051 174.5087 107 T 5.0419 8.7454 115.3484 60.2754 71.1142 175.0146 108 S 4.4576 8.8339 120.9031 59.7661 63.6369 174.9999 109 K 4.1461 8.1530 123.0887 55.1343 32.7512 174.3015 110 P 4.9024 0.0000 0.0000 62.4983 32.9233 177.7355 111 T 3.8865 8.7284 119.5372 66.7465 68.2825 177.3265 112 V 3.5722 7.5285 120.4727 64.9365 31.2715 178.4063 113 F 4.6039 7.7211 118.0396 60.3882 38.9453 177.6775 114 S 4.2338 8.4556 114.9689 61.4975 62.5520 176.8073 115 K 3.9475 8.3546 122.3033 59.6515 31.9279 178.8390 116 Q 4.0330 7.9175 118.3362 59.0528 28.5834 179.1186 117 I 3.7197 8.0692 120.7891 64.5585 37.1872 178.6045 118 L 4.2357 8.2168 119.8265 57.8131 41.3309 179.5399 119 E 3.9957 8.5352 118.9059 59.5144 29.2266 178.5529 120 H 4.0525 8.3305 117.6330 59.1031 29.9580 176.3853 121 F 4.6344 8.1645 116.2195 56.5633 39.1233 175.6405 122 K 4.0116 8.1956 117.1481 57.9289 29.9912 176.1861 123 L 4.9749 8.4479 117.2880 54.4158 43.6793 178.5426 124 A 4.1838 8.3079 122.5590 55.4886 18.2281 179.3748 125 F 4.5781 7.8698 111.3774 59.4080 39.1733 176.0396 126 Y 4.2573 7.7447 117.9241 59.4290 37.9348 175.5800 127 F 5.1899 7.6470 118.1805 55.8351 40.8399 175.7632 128 D 4.8158 9.6526 124.6457 57.3357 41.4599 176.4642 129 A 4.6329 7.9017 117.0790 51.0979 22.7345 175.7286 130 I 4.6103 8.4717 120.2529 59.6462 39.8664 175.2671 131 V 4.2091 9.1634 129.2095 61.4613 33.0182 174.4649 132 G 5.2978 8.4408 117.7651 44.8272 0.0000 171.6957 133 S 4.8581 8.5294 115.1448 57.8692 65.2384 173.3418 134 S 4.6540 8.4407 115.1185 56.9413 64.1030 175.3434 135 L 3.9618 8.7159 122.6000 58.1246 41.4394 178.0448 136 D 4.4164 8.0171 114.9216 53.3139 39.7237 177.1311 137 G 3.9105 8.5710 108.3374 45.9141 0.0000 175.0143 138 K 3.9248 9.1079 120.5515 58.1076 32.3671 176.6711 139 L 4.5947 7.6902 121.2022 53.4463 43.0808 175.8856 140 S 4.6369 8.2891 118.0995 58.0529 68.4585 175.7018 141 T 4.0627 7.7213 111.8355 60.9329 70.6588 174.8854 142 K 3.8434 8.6034 123.4742 59.8671 32.2001 178.5387 143 E 3.9408 8.1780 118.8004 59.6521 29.5909 178.4891 144 D 4.4095 7.8348 118.4022 57.2200 40.7419 178.9630 145 V 3.7304 8.0190 118.9613 65.8236 31.3142 178.2369 146 I 3.7147 7.7035 118.8391 64.3519 37.0407 177.9891 147 R 4.1919 7.7709 119.7168 59.1006 30.2047 177.6544 148 Y 4.3193 8.1919 119.1677 60.3629 38.7306 177.8132 149 A 4.0202 8.1692 118.3132 53.0048 18.0034 178.7673 *151 E 4.1522 8.0908 121.6207 57.9286 31.4766 178.6865 152 S 3.8815 8.1320 113.8064 60.8612 62.8042 175.1614 153 L 4.3370 7.6695 117.0925 53.5068 42.2901 175.5442 154 N 4.0277 7.2533 116.5418 54.4522 37.5320 173.9906 155 I 4.0233 7.1879 117.3379 59.8602 39.2000 176.2941 156 K 4.4993 8.1516 123.7906 54.9034 33.5730 177.9403 157 S 4.0890 8.6576 117.8491 61.4295 62.8563 175.0987 158 D 4.8015 8.0205 117.4462 53.2147 39.4860 175.8139 159 D 5.0398 8.3522 117.5563 53.7678 42.0950 174.4396 160 A 5.8513 7.8888 117.3797 51.6134 22.7322 176.5263 161 I 4.3020 7.4855 114.3974 59.9460 41.4001 174.4552 *163 I 4.2271 8.4010 120.4016 61.3330 38.7309 175.1984 164 G 4.5337 8.7107 112.7197 45.2764 0.0000 172.8237 165 D 5.0796 8.9052 116.5381 52.0511 40.9969 176.0014 166 R 5.1656 7.9194 118.9602 53.6342 33.4939 176.4015 167 E 3.8675 8.9056 118.3041 59.8267 29.1194 179.0559 168 Y 4.1403 7.3750 117.2416 61.0219 37.8957 178.1246 169 D 4.3736 8.1380 120.0261 57.1695 40.8993 178.9519 170 V 3.5423 7.6366 118.2591 66.0601 31.6257 177.9503 171 I 3.7799 8.1093 120.0780 64.4236 36.5154 178.7160 172 G 3.6051 8.4370 106.5079 47.5435 0.0000 175.7351 173 A 3.8605 8.1703 123.0265 54.9830 18.4016 179.5117 174 L 3.9050 8.2176 117.9640 58.1056 41.5857 179.9568 175 K 4.1097 8.1235 116.1158 58.1894 32.0813 177.4198 176 N 4.8571 7.3464 115.6394 52.2021 39.1039 174.3488 177 N 4.0447 8.1885 114.4438 54.6047 36.6781 173.9129 178 L 4.9243 7.9093 116.8495 52.0857 44.2310 175.5612 179 P 4.7348 0.0000 0.0000 62.8382 32.7318 175.5535 180 S 4.7683 8.6752 114.3828 56.6724 67.0628 172.5605 181 I 4.8787 8.3387 122.4588 59.7281 39.5966 174.6304 182 G 4.2487 9.6655 116.2680 45.0150 0.0000 172.5945 183 V 5.0305 8.4805 116.8569 59.5499 34.1204 176.3503 184 T 4.6351 8.7310 113.7751 61.7689 69.8125 175.3321 185 Y 4.3625 7.4777 119.5022 57.6904 39.5184 176.3560 186 G 3.8917 6.3233 110.9374 45.3467 0.0000 174.8174 187 F 4.7342 9.7238 125.1800 56.7187 39.1089 175.3039 188 G 4.7562 8.0616 108.5195 42.7625 0.0000 173.5745 189 S 4.7740 8.0528 115.0574 56.2848 66.6780 174.5519 190 Y 4.0060 8.4731 122.8817 61.1927 38.4743 178.2861 191 E 3.9115 8.3460 118.7158 59.3515 29.1968 178.8156 192 E 3.8449 8.0750 119.2113 59.3523 29.6773 178.9804 193 L 3.8794 7.8792 119.0149 57.3633 41.5362 179.3771 194 K 3.6426 7.9894 120.0353 59.5153 31.9391 178.5658 195 N 4.3995 7.8822 114.4066 55.2856 38.5242 176.6785 196 A 4.1758 7.2079 121.2586 52.8401 18.7476 178.1732 197 G 3.9056 7.8075 104.4594 44.9871 0.0000 173.5234 198 A 3.8397 7.6713 121.5798 52.6904 18.5350 178.4087 199 N 4.3302 8.3038 119.9210 55.6745 39.3307 175.2333 200 Y 4.8304 7.9718 115.1265 56.6606 43.0925 174.1879 201 I 5.2944 8.3974 122.4518 59.9349 40.8248 174.9971 202 V 4.7528 9.1446 120.1906 59.5910 35.5012 176.0733 203 N 5.3549 9.1639 118.1526 52.2530 38.2810 174.8496 204 S 4.6475 7.5279 113.3708 56.3156 67.2076 174.9182 205 V 3.5918 7.9145 121.4305 66.0529 31.2249 177.6207 206 D 4.3023 7.9492 117.5270 57.3233 41.1998 177.8886 207 E 4.0321 8.3032 119.2263 59.1285 29.4008 179.1154 208 L 3.9785 8.0340 120.5432 58.2644 42.0608 178.3106 209 H 4.0001 8.3458 118.3026 59.3404 29.8253 177.1435 210 K 3.9510 8.0816 120.0570 59.5321 31.7140 179.2340 211 K 3.9513 7.9109 118.3599 59.4955 32.1570 178.4920 212 I 3.7540 7.5726 119.1969 64.3540 37.2510 178.1621 213 L 4.1275 7.6323 120.0063 57.6133 41.3846 178.9743 214 E 4.1468 8.0547 114.2676 57.7845 29.4256 177.3455 215 L 4.4015 7.7954 125.5404 55.2811 42.0276 176.0771 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 0 S 8.32 4.50 0.00 4.11 4.08 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 1 L 7.78 3.93 0.00 1.75 1.69 0.92 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 2 Y 8.72 5.11 0.00 3.25 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 3 N 10.04 4.86 0.00 2.81 2.67 0.00 0.00 6.87 7.77 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 4 Y 8.83 5.42 0.00 3.10 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 5 V 8.91 4.54 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.61 0.00 0.00 6 L 8.60 5.22 0.00 1.66 1.59 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 7 F 9.32 5.15 0.00 2.93 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 8 D 8.87 4.99 0.00 3.03 2.65 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 9 L 8.60 4.47 0.00 1.79 1.58 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 10 D 7.86 4.69 0.00 2.80 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 11 G 10.02 4.66 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 12 T 8.19 4.35 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 13 L 8.64 4.58 0.00 1.89 1.76 0.86 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.76 4.68 4.41 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 1.06 0.00 0.00 15 D 8.28 4.58 0.00 1.58 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.64 4.93 0.00 4.16 4.34 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 17 A 8.00 3.84 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 18 E 8.44 3.98 0.00 2.10 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 2.45 2.45 0.00 19 G 8.13 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 20 I 7.93 3.87 1.89 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 1.69 1.21 1.02 0.00 0.00 21 T 8.47 3.90 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 1.25 0.00 0.00 22 K 8.13 3.87 0.00 2.12 1.63 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.57 7.81 23 S 7.95 3.98 0.00 3.24 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.91 3.84 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 -0.08 0.00 0.00 0.82 0.00 0.00 25 K 8.21 3.89 0.00 1.86 1.85 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.41 7.81 26 Y 7.85 3.87 0.00 2.63 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 27 S 8.23 4.14 0.00 4.45 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 0.00 28 L 8.55 4.28 0.00 1.63 1.63 0.70 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.21 4.70 0.00 2.77 2.71 0.00 0.00 6.66 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.23 3.75 0.00 0.93 0.74 0.00 0.98 0.00 0.00 1.11 0.00 0.00 2.70 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.65 0.21 7.81 31 F 8.07 4.69 0.00 3.25 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 32 D 7.61 4.56 0.00 2.88 2.78 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 33 I 7.23 4.32 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.29 0.98 0.00 0.00 34 Q 8.47 4.66 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 35 V 7.92 4.51 2.12 0.00 0.00 0.00 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 0.93 0.00 0.00 36 E 9.16 4.16 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 37 D 8.06 4.82 0.00 2.84 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 38 L 8.87 3.91 0.00 1.75 1.80 0.93 0.77 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 39 S 8.62 3.96 0.00 3.89 4.19 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 40 S 8.22 4.39 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.72 4.72 0.00 1.72 1.61 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.21 4.34 0.00 3.00 3.05 0.00 0.00 6.75 7.61 0.00 0.00 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 K 7.95 4.13 0.00 1.76 1.83 0.00 1.47 0.00 0.00 1.45 0.00 0.00 2.74 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.72 0.21 7.81 44 F 7.96 3.94 0.00 3.19 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 45 V 7.98 3.75 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.58 0.00 0.00 46 G 8.58 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.14 0.00 1.64 0.77 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 48 P 0.00 4.22 0.00 2.06 1.93 0.00 3.30 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.19 0.00 49 L 8.47 3.86 0.00 1.65 1.80 -0.20 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.07 4.01 0.00 1.78 1.85 0.00 1.79 0.00 0.00 2.10 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.57 7.81 51 T 7.81 3.92 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 1.10 0.00 0.00 52 S 7.60 3.93 0.00 3.50 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 53 F 8.37 4.88 0.00 3.29 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *55 E 8.05 3.96 0.00 1.69 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.02 0.00 56 Y 7.65 4.22 0.00 2.98 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.63 4.35 0.00 2.58 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.32 4.17 0.00 2.79 2.85 0.00 0.00 7.09 7.45 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 59 F 7.40 4.71 0.00 3.13 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 60 D 8.38 4.78 0.00 2.95 2.85 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 61 E 8.74 3.90 0.00 2.09 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 2.38 2.45 0.00 62 E 8.10 3.94 0.00 2.19 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 0.00 2.54 2.34 0.00 63 T 9.12 3.69 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 0.08 0.00 0.00 64 A 8.26 3.99 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.76 3.79 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 1.17 0.00 0.00 66 V 7.43 3.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.84 0.00 0.00 67 A 7.81 4.14 0.57 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 0.00 0.00 68 I 7.80 3.88 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.95 0.97 0.00 0.00 69 D 7.86 4.45 0.00 2.66 2.66 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 70 Y 7.70 5.34 0.00 3.25 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 8.47 4.67 0.00 3.49 3.29 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 72 R 8.77 4.26 0.00 2.30 2.29 0.00 3.40 0.00 0.00 3.50 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 73 D 8.34 4.42 0.00 3.02 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 74 Y 7.60 3.78 0.00 2.34 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.42 3.70 0.00 2.60 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 76 K 8.05 3.35 0.00 2.03 2.08 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.21 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.43 7.81 77 A 7.01 4.58 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 78 K 7.55 4.23 0.00 0.79 1.25 0.00 1.58 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.06 1.04 7.81 79 G 6.92 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *81 F 8.09 4.69 0.00 3.06 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 82 E 7.41 4.40 0.00 2.25 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 0.00 2.35 2.48 0.00 83 N 7.75 5.40 0.00 2.88 3.14 0.00 0.00 6.84 6.75 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 84 K 8.21 4.58 0.00 1.60 1.49 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.39 1.41 7.81 85 V 7.70 4.09 1.91 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 0.73 0.00 0.00 0.40 0.00 0.00 86 Y 8.39 4.25 0.00 2.92 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.71 4.34 0.00 2.64 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 88 G 8.89 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.63 3.60 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.25 0.87 0.00 0.00 90 E 8.14 3.65 0.00 2.06 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 2.42 2.38 0.00 91 A 7.91 3.93 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 92 L 7.96 3.91 0.00 1.83 1.85 0.92 0.96 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 93 L 7.77 3.68 0.00 0.81 0.83 0.69 0.56 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 94 S 7.74 4.03 0.00 3.92 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 95 S 8.19 4.21 0.00 4.11 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 96 L 8.25 4.29 0.00 1.91 1.85 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.24 4.33 0.00 1.92 1.93 0.00 1.94 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.64 7.81 98 D 7.91 4.33 0.00 2.90 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 99 Y 7.98 3.92 0.00 3.25 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 0.00 100 G 7.69 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 0.00 0.00 0.00 101 F 7.76 4.51 0.00 3.20 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 0.00 102 H 9.55 4.82 0.00 2.38 3.25 0.00 5.79 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.66 5.55 0.00 1.75 1.89 0.75 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 104 V 9.32 5.20 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 1.23 0.00 0.00 105 V 8.71 4.76 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 0.82 0.00 0.00 0.02 0.00 0.00 106 A 9.36 5.18 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.75 5.04 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 108 S 8.83 4.46 0.00 4.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.15 4.15 0.00 1.83 1.74 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.18 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.62 1.49 7.81 110 P 0.00 4.90 0.00 1.83 1.70 0.00 4.18 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 2.23 2.03 0.00 111 T 8.73 3.89 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 112 V 7.53 3.57 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 0.28 0.00 0.00 0.88 0.00 0.00 113 F 7.72 4.60 0.00 3.37 3.29 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 0.00 114 S 8.46 4.23 0.00 4.02 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 0.00 115 K 8.35 3.95 0.00 1.94 1.82 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.53 1.47 7.81 116 Q 7.92 4.03 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.71 0.00 117 I 8.07 3.72 2.20 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.66 1.25 0.00 0.00 118 L 8.22 4.24 0.00 1.79 1.84 0.74 0.90 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 0.00 119 E 8.54 4.00 0.00 2.03 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 2.22 2.61 0.00 120 H 8.33 4.05 0.00 3.18 3.35 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 8.16 4.63 0.00 3.28 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 0.00 122 K 8.20 4.01 0.00 2.03 2.01 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.59 7.81 123 L 8.45 4.97 0.00 1.99 2.09 1.04 1.16 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 0.00 124 A 8.31 4.18 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.87 4.58 0.00 2.94 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 0.00 126 Y 7.74 4.26 0.00 2.59 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 F 7.65 5.19 0.00 3.32 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.65 4.82 0.00 2.91 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 0.00 129 A 7.90 4.63 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 0.00 130 I 8.47 4.61 1.87 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 1.01 0.74 0.87 0.00 0.00 131 V 9.16 4.21 2.22 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 1.12 0.00 0.00 0.97 0.00 0.00 132 G 8.44 5.30 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 0.00 133 S 8.53 4.86 0.00 4.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.44 4.65 0.00 3.86 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 0.00 135 L 8.72 3.96 0.00 1.58 1.75 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.02 4.42 0.00 2.73 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 0.00 137 G 8.57 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 9.11 3.92 0.00 1.72 1.83 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.53 7.81 139 L 7.69 4.59 0.00 1.45 1.37 0.86 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 140 S 8.29 4.64 0.00 3.92 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 0.00 141 T 7.72 4.06 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 1.18 0.00 0.00 142 K 8.60 3.84 0.00 1.92 1.91 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.61 7.81 143 E 8.18 3.94 0.00 2.08 1.94 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 2.39 2.41 0.00 144 D 7.83 4.41 0.00 2.84 2.68 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 0.00 145 V 8.02 3.73 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 1.27 0.00 0.00 1.03 0.00 0.00 146 I 7.70 3.71 1.94 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 1.42 0.78 0.91 0.00 0.00 147 R 7.77 4.19 0.00 2.06 2.15 0.00 3.13 0.00 0.00 3.02 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.51 0.00 148 Y 8.19 4.32 0.00 3.18 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 0.00 149 A 8.17 4.02 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 *151 E 8.09 4.15 0.00 2.14 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 0.00 2.28 2.53 0.00 152 S 8.13 3.88 0.00 3.67 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 0.00 153 L 7.67 4.34 0.00 1.46 1.58 0.96 1.17 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 0.00 154 N 7.25 4.03 0.00 2.72 2.79 0.00 0.00 7.07 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 0.00 155 I 7.19 4.02 1.61 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.20 0.60 0.00 0.00 156 K 8.15 4.50 0.00 1.87 1.78 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.40 7.81 157 S 8.66 4.09 0.00 3.85 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 0.00 158 D 8.02 4.80 0.00 2.82 2.78 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 0.00 159 D 8.35 5.04 0.00 2.84 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 0.00 160 A 7.89 5.85 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 0.00 161 I 7.49 4.30 1.51 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.42 -0.09 0.00 0.00 *163 I 8.40 4.23 1.57 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.21 0.99 0.00 0.00 164 G 8.71 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.91 5.08 0.00 2.69 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 0.00 166 R 7.92 5.17 0.00 2.04 2.01 0.00 3.44 0.00 0.00 3.42 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 167 E 8.91 3.87 0.00 1.92 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 1.51 1.47 0.00 168 Y 7.38 4.14 0.00 3.06 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 0.00 169 D 8.14 4.37 0.00 2.89 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 0.00 170 V 7.64 3.54 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.86 0.00 0.00 171 I 8.11 3.78 1.88 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.49 0.91 0.00 0.00 172 G 8.44 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 8.17 3.86 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 0.00 174 L 8.22 3.90 0.00 1.79 1.72 0.87 0.81 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 0.00 175 K 8.12 4.11 0.00 1.86 2.05 0.00 1.66 0.00 0.00 1.98 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.73 7.81 176 N 7.35 4.86 0.00 2.63 2.76 0.00 0.00 6.86 6.80 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 0.00 177 N 8.19 4.04 0.00 2.83 2.88 0.00 0.00 6.71 8.10 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 0.00 178 L 7.91 4.92 0.00 1.55 1.49 0.88 1.08 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 0.00 179 P 0.00 4.73 0.00 2.26 2.14 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.83 0.00 180 S 8.68 4.77 0.00 3.85 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 0.00 181 I 8.34 4.88 1.78 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.91 0.92 0.00 0.00 182 G 9.67 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 0.00 0.00 0.00 0.00 183 V 8.48 5.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.14 0.00 0.00 184 T 8.73 4.64 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 1.30 0.00 0.00 185 Y 7.48 4.36 0.00 2.84 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 0.00 186 G 6.32 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 0.00 187 F 9.72 4.73 0.00 3.23 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 0.00 188 G 8.06 4.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 S 8.05 4.77 0.00 4.08 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 0.00 190 Y 8.47 4.01 0.00 3.10 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 0.00 191 E 8.35 3.91 0.00 2.12 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 2.46 2.56 0.00 192 E 8.07 3.84 0.00 2.00 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 0.00 2.18 2.24 0.00 193 L 7.88 3.88 0.00 1.65 1.54 0.85 0.64 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 0.00 194 K 7.99 3.64 0.00 0.99 1.42 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.29 1.29 7.81 195 N 7.88 4.40 0.00 2.73 2.79 0.00 0.00 7.06 6.65 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 0.00 196 A 7.21 4.18 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.81 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 A 7.67 3.84 1.21 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 0.00 0.00 199 N 8.30 4.33 0.00 2.92 2.31 0.00 0.00 6.83 7.22 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 0.00 200 Y 7.97 4.83 0.00 2.85 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 0.00 201 I 8.40 5.29 2.00 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 1.27 0.54 1.04 0.00 0.00 202 V 9.14 4.75 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 0.90 0.00 0.00 1.10 0.00 0.00 203 N 9.16 5.35 0.00 2.83 2.94 0.00 0.00 6.19 7.64 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 0.00 204 S 7.53 4.65 0.00 3.96 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 0.00 205 V 7.91 3.59 1.91 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 1.07 0.00 0.00 0.42 0.00 0.00 206 D 7.95 4.30 0.00 2.80 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 0.00 207 E 8.30 4.03 0.00 2.29 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 2.35 2.66 0.00 208 L 8.03 3.98 0.00 2.02 1.91 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 209 H 8.35 4.00 0.00 3.34 3.45 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 K 8.08 3.95 0.00 2.02 1.87 0.00 1.74 0.00 0.00 1.59 0.00 0.00 3.15 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.71 7.81 211 K 7.91 3.95 0.00 1.89 1.92 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.41 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.46 1.36 7.81 212 I 7.57 3.75 1.81 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 1.32 0.75 0.41 0.00 0.00 213 L 7.63 4.13 0.00 1.76 1.64 0.84 0.22 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 0.00 214 E 8.05 4.15 0.00 2.16 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 0.00 2.62 2.38 0.00 215 L 7.80 4.40 0.00 2.02 1.84 -0.07 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.