NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6335 8.1633 120.6028 55.5265 33.8951 173.3516 2 K 4.7439 8.9603 126.5217 54.3261 34.1534 173.9609 3 I 5.2182 9.6769 128.9759 59.4118 40.6071 174.4844 4 A 5.0808 8.7203 127.4608 50.0571 22.3464 174.7175 5 I 4.9839 9.2774 122.8302 59.4850 40.0767 174.5224 6 F 5.2445 10.2569 129.5974 55.3840 42.4120 174.4257 7 G 3.9682 7.5559 113.1788 46.2010 0.0000 171.5328 8 T 3.3975 6.9358 114.6523 60.2997 68.1816 173.5252 9 V 3.7893 8.1272 124.2667 64.4843 31.7331 175.8128 10 G 3.7204 8.9843 114.6226 45.7658 0.0000 174.6786 11 A 3.8958 7.5777 123.6632 53.1640 18.7318 179.2408 12 G 3.9133 8.0944 104.0350 46.1465 0.0000 176.1491 13 K 3.9809 8.3276 121.0396 59.0206 32.0619 178.7957 14 S 4.1634 7.8959 115.2910 61.2493 62.9871 176.2288 15 T 3.8363 7.9209 119.3276 66.2927 68.2253 176.2626 16 I 3.7171 7.7188 121.5125 64.4586 36.6972 178.5460 17 S 4.1545 8.5865 115.2040 61.5564 62.6373 176.3695 18 A 3.9983 8.2392 124.4450 54.8022 18.2540 179.4346 19 E 3.8734 8.2184 116.9640 59.5993 29.4958 179.5480 20 I 3.6418 7.8223 119.7247 64.5641 37.1464 178.2074 21 S 4.0132 8.1448 113.8249 61.4174 61.8826 176.1093 22 K 3.8204 7.6903 121.0606 59.5625 31.9904 178.6111 23 K 4.0985 7.7638 117.1640 58.7477 32.1302 178.5156 24 L 4.2388 8.0003 117.6683 54.0364 42.6193 177.9070 25 G 4.0293 8.5749 106.7706 45.1098 0.0000 173.3811 26 Y 4.5532 7.2904 117.0264 57.6623 38.8415 175.0408 27 E 4.1426 8.8264 124.5996 56.3836 31.0169 175.3701 28 I 4.7789 8.1978 127.4090 60.4984 38.4531 175.3233 29 F 4.3666 8.9379 125.7977 55.6275 40.2718 175.6553 30 K 4.2781 8.3768 123.2413 55.6741 33.3062 176.6988 31 E 4.4545 8.4932 121.2178 54.4257 30.8266 174.6019 32 P 4.4788 0.0000 0.0000 62.8089 32.0031 175.9440 33 V 3.9147 8.2588 121.4198 63.8237 33.7457 176.0171 34 E 3.9812 8.0526 118.8344 58.7785 29.7156 176.6482 35 E 4.2283 7.9853 114.7736 56.3555 29.7348 175.6099 36 N 4.1013 7.7732 119.8233 51.7521 38.6934 173.6292 37 P 4.2636 0.0000 0.0000 64.3451 31.9134 176.3805 38 Y 4.5495 8.1372 116.9075 58.0084 38.4182 177.0289 39 F 4.1050 7.8741 122.9411 61.5575 39.3728 176.3691 40 E 4.0573 8.3597 117.8919 59.4870 29.6088 178.6543 41 Q 4.0034 8.2196 117.4969 59.2390 28.8689 178.2433 42 Y 4.0044 8.5269 120.4903 61.1636 38.5996 178.0344 43 Y 3.7998 7.0410 114.4448 60.5469 37.9500 178.0862 44 K 4.3296 7.8477 119.1324 58.3706 33.0249 177.0552 45 D 4.4933 7.7812 117.7450 52.8068 42.5115 174.4997 46 L 3.7809 7.9585 123.6558 56.5303 42.2651 179.7005 47 K 3.8969 8.1306 116.7309 59.7790 31.9878 178.4092 48 K 4.2596 8.1071 115.2028 58.1355 32.3276 177.7288 49 T 4.5564 8.3016 114.2220 62.8367 70.9401 176.1027 50 V 3.6960 8.1643 121.1017 66.2227 31.2621 177.8023 51 F 3.8431 8.1747 116.6241 60.3941 38.9406 177.5090 52 K 3.6577 8.0614 117.6362 59.5948 31.7897 178.7597 53 M 3.7629 8.4798 118.7928 58.6600 32.0864 178.2181 54 Q 3.9564 8.2090 118.4354 59.0872 28.9848 178.8429 55 I 3.7443 7.9412 120.8812 64.5809 37.0611 177.7850 56 Y 4.0778 7.9775 120.1385 61.0178 38.5845 178.1747 57 M 4.1025 8.2409 119.4822 58.5561 32.1315 178.8290 58 L 4.1185 8.2400 119.1517 57.9379 41.6044 179.8060 59 T 3.8095 7.8228 115.1077 66.4471 68.4008 176.3704 60 A 3.8406 7.8893 122.8032 55.2690 18.3239 179.5898 61 R 3.9719 8.2537 116.8437 59.8624 30.2344 179.2471 62 S 4.1064 8.1368 112.4469 61.1819 62.0387 176.4722 63 K 3.9949 7.5796 120.5139 59.4548 32.2707 178.8916 64 Q 4.2495 8.2666 118.3874 58.8570 28.6673 178.6530 65 L 3.9528 8.3096 121.5448 58.1245 41.9211 179.8441 66 K 4.5070 7.7479 115.8522 56.3457 32.4654 177.8261 67 Q 4.5402 8.2906 115.0815 55.8591 31.7575 174.8639 68 A 4.5258 7.8825 120.3525 51.5827 20.2026 178.2115 69 K 3.7489 8.2270 115.5569 59.5456 31.9918 177.7314 70 N 4.5991 7.8890 111.6736 53.4756 39.1055 175.3111 71 L 4.2302 7.3377 120.0574 54.2010 42.3950 176.8225 72 E 3.9719 8.9912 123.7969 59.0693 29.6404 176.7159 73 N 5.2512 8.0524 115.0916 50.4370 40.3508 174.1789 74 I 5.0018 8.1924 116.2865 59.1772 42.0084 174.1652 75 I 5.2349 9.1040 124.4019 59.9665 40.0781 174.5802 76 F 4.8229 9.8032 127.6126 55.7898 40.4593 175.2509 77 D 4.7014 8.2782 124.0966 54.9371 39.6926 174.5352 78 R 4.3602 8.9671 124.9926 56.3013 31.6209 175.9519 79 T 4.5966 8.9845 114.2481 60.3329 70.5770 174.6441 80 L 4.4745 8.5059 119.6068 55.8167 41.8778 177.6702 81 L 5.5182 7.7406 117.2798 53.9609 41.9492 176.7459 82 E 4.5279 8.1764 116.8220 56.2309 30.7975 177.6384 83 D 4.6914 8.4027 120.1307 57.0776 40.9096 176.5431 84 P 4.4940 0.0000 0.0000 65.2461 31.2073 178.6229 85 I 3.6399 7.5480 118.9941 64.4457 36.9924 178.3509 86 F 4.1100 7.9978 118.4898 60.6603 38.8263 177.4880 87 M 3.9299 7.9880 117.4914 58.3772 31.9864 177.9774 88 K 4.0783 8.3635 119.9551 59.4214 32.3385 178.6109 89 V 3.4774 7.7707 118.5207 66.4235 31.3526 177.8589 90 N 4.4048 8.1270 115.2450 56.1330 38.3214 176.9528 91 Y 4.4360 7.6757 122.1897 60.1963 38.6961 177.1691 92 D 4.0840 7.9095 118.6577 57.0084 40.9212 177.8581 93 L 4.3459 7.6883 116.6768 53.8151 41.6474 176.3636 94 N 4.2383 7.5674 113.9710 54.3576 36.7054 175.3942 95 N 4.5476 8.3854 117.9157 55.0383 38.7208 175.9837 96 V 4.5014 7.5414 117.5342 60.1824 34.7027 174.9478 97 D 4.8771 8.5987 126.9292 52.6063 42.2488 176.8655 98 Q 4.0885 8.7034 118.8150 59.7751 29.0255 177.9724 99 T 3.9053 7.9917 116.1862 66.9369 68.5289 175.8432 100 D 4.5895 8.5868 120.5534 57.8420 40.9334 178.5071 101 Y 4.0777 7.9792 119.2362 60.8574 38.6604 177.8332 102 N 4.2228 8.3312 117.9219 56.7161 39.0354 177.0086 103 T 3.9020 8.6190 117.5961 66.7478 68.5343 175.6246 104 Y 4.2408 8.4152 121.6627 61.2233 38.7484 178.5736 105 I 3.5585 7.6895 120.4476 64.1526 37.0110 177.8023 106 D 4.3529 8.4353 119.4300 57.3615 40.9224 178.3377 107 F 4.0540 8.3952 121.0575 61.2296 39.4629 176.3790 108 Y 3.6946 8.0258 119.3531 60.7476 37.4541 177.8027 109 N 4.3193 8.5121 117.4893 56.7492 38.5316 177.3134 110 N 4.5394 7.6702 116.2387 55.4904 38.6203 176.4071 111 V 3.7970 7.0485 117.5012 64.5052 32.5731 177.7379 112 V 3.3743 6.6930 116.7744 66.0089 31.6491 177.9185 113 L 3.9844 7.3509 117.2331 56.2851 41.5712 177.6976 114 E 4.2231 6.9475 119.7450 56.0425 30.6784 175.0925 115 N 4.2010 7.9662 124.3342 52.1804 40.8155 175.1252 *122 K 3.8864 8.5786 118.3577 55.9214 33.0088 174.6547 123 L 4.2400 8.1768 126.0352 52.9957 43.0478 176.3571 124 S 4.4425 7.8430 116.8240 56.0855 63.8443 173.5547 125 F 4.3779 8.3737 124.8284 57.4143 39.3558 176.0172 126 D 4.6331 8.7356 125.0061 57.0400 41.5715 176.7871 127 I 4.6269 7.6901 117.8413 59.7140 41.9340 173.5446 128 V 4.3231 8.6779 129.5472 61.2218 33.4490 174.7822 129 I 4.6851 8.9971 131.5021 60.5491 37.9374 175.1400 130 Y 5.3485 8.9906 130.6026 57.2115 39.3178 174.6930 131 L 4.6280 9.2568 129.1621 54.2036 41.0950 175.5039 132 R 3.6922 8.0986 124.3567 55.2982 30.9545 175.3615 133 V 4.8757 8.0400 118.7385 59.1524 35.9773 175.7551 134 S 4.3796 9.2698 117.5705 58.2115 64.0285 175.6186 135 T 3.8854 8.5599 118.5506 66.8631 67.9615 176.9688 136 K 3.9625 8.0118 119.8169 59.8705 32.1249 179.3804 137 T 3.8320 7.8708 115.4660 66.3090 68.2223 176.6649 138 A 4.2055 7.6463 123.6313 54.8188 18.4356 179.7227 139 I 3.3076 7.7179 118.5278 64.4083 37.0243 178.8837 140 S 4.1176 7.7681 115.0772 61.4284 62.9167 176.8239 141 R 3.8321 7.9133 121.6937 58.7802 29.8539 178.8087 142 I 3.5305 7.7979 120.0960 64.4823 36.8465 178.5849 143 K 3.9832 7.4279 117.3659 59.6197 31.9189 179.1779 144 K 4.1397 8.1402 118.2287 58.4615 32.0200 177.9189 145 R 4.5877 8.0879 115.3478 55.6926 31.9032 176.9027 146 G 3.9056 7.6938 108.0190 45.0363 0.0000 173.3850 147 R 4.6383 8.7659 118.4939 54.3735 31.4891 178.0307 148 S 4.2399 8.6144 115.6778 61.2412 63.4714 176.4184 149 E 4.1178 8.3208 120.5193 59.0346 29.4594 178.2904 150 E 3.3274 7.8735 116.9044 57.8943 29.4508 177.5802 151 L 4.3588 7.2442 116.6305 55.6092 42.0426 177.7524 152 L 4.1642 7.6953 118.7093 55.9254 41.9282 176.8284 153 I 4.3714 7.3082 111.0602 58.3124 39.9569 175.4301 154 G 3.8700 8.1164 110.0062 45.1088 0.0000 174.5017 155 E 4.2945 8.8861 119.1884 59.5952 29.4516 179.5796 156 E 4.0477 8.2925 118.0135 59.3500 29.4652 178.6381 157 Y 3.8514 7.6928 119.5832 60.5224 38.8406 178.1797 158 W 4.5482 7.8828 119.2660 59.4493 29.2590 178.2740 159 E 4.0118 8.3339 118.8455 59.9545 28.9199 179.4749 160 T 3.8421 7.7034 115.0820 66.5766 68.4903 176.5400 161 L 3.8218 7.7217 122.2143 58.0267 42.0789 178.5680 162 N 4.4653 8.3838 117.1880 56.3566 38.8201 177.1619 163 K 4.0336 8.2340 120.0657 59.6929 32.1346 179.1684 164 N 4.3908 8.5401 117.0139 56.3504 38.4447 177.2189 165 Y 3.6926 8.1897 118.4407 60.8657 37.9597 178.0297 166 E 4.2041 8.5940 120.3941 59.3407 29.7746 178.4870 167 E 3.9971 8.5717 119.5890 59.1146 29.6279 178.5078 168 F 3.9986 8.5991 121.0535 61.4768 39.2530 176.5449 169 Y 3.7058 7.8773 117.4610 60.5587 38.6243 177.7071 170 K 3.7391 7.9485 118.3833 59.3531 32.1896 179.0629 171 Q 3.8984 8.0393 117.5679 56.5156 29.4805 175.7662 172 N 3.8969 8.2366 117.9092 53.6083 38.2130 175.6106 173 V 3.1537 7.2280 118.2419 66.2974 31.5165 176.0099 174 Y 4.2034 6.7833 112.6473 57.3276 38.3528 174.6899 175 D 4.2362 7.6775 119.2038 55.2023 39.9053 173.6814 176 F 4.6492 7.9640 117.8328 57.0592 40.2033 175.6134 177 P 4.7543 0.0000 0.0000 62.3551 29.5432 174.5893 178 F 5.1794 8.3808 125.4791 58.4452 40.5607 174.5627 179 F 5.0289 9.4479 124.6196 56.5078 42.1032 173.7554 180 V 4.1239 8.2386 126.7689 62.3839 32.5156 175.2215 181 V 4.0839 8.0985 126.8187 60.7894 34.8876 174.0977 182 D 4.3916 8.5584 126.9598 53.9856 40.9387 175.9333 183 A 4.3912 8.4986 127.2016 53.0915 18.1787 178.2194 184 E 3.9961 8.4897 115.4107 58.5782 29.8538 177.9417 185 L 4.0993 7.4734 118.4599 54.2627 42.4753 177.2286 186 D 4.5529 8.3844 121.3633 53.2123 41.3211 177.8888 187 V 3.5325 8.1798 119.3115 66.2387 31.5066 177.9520 188 K 3.8559 8.1744 117.7119 60.2200 31.8455 179.1603 189 T 3.9352 8.4407 115.6728 66.5988 68.4077 176.8550 190 Q 4.0309 7.9393 119.5386 59.2376 28.6925 179.2110 191 I 3.8049 7.9010 120.6737 64.1084 37.0656 178.3148 192 E 3.9566 7.9862 119.6367 59.5419 29.4032 179.2411 193 L 4.1082 7.9493 118.8327 57.9794 41.6863 179.9013 194 I 3.9036 8.0297 119.4725 64.8094 37.1655 178.2407 195 M 4.0626 8.4026 119.9030 58.5845 31.5564 178.5348 196 N 4.3113 7.9751 115.3869 56.2723 38.8211 177.0734 197 K 3.8922 7.5932 119.1710 59.4034 32.4515 178.4686 198 L 4.1477 8.2578 119.6844 57.7282 41.2284 179.5090 199 N 4.9096 7.9797 113.5062 53.3528 38.4966 175.3556 200 S 4.1863 8.1020 122.9319 58.9467 64.2058 173.9838 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 8.16 4.63 0.00 2.24 2.16 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 2.81 2.94 0.00 2 K 8.96 4.74 0.00 1.67 1.57 0.00 1.63 0.00 0.00 1.31 0.00 0.00 2.75 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.23 1.46 7.81 3 I 9.68 5.22 2.10 0.00 0.00 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 1.31 1.05 1.04 0.00 0.00 4 A 8.72 5.08 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 9.28 4.98 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.97 1.00 0.00 0.00 6 F 10.26 5.24 0.00 3.18 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.56 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 0.00 0.00 0.00 8 T 6.94 3.40 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 1.09 0.00 0.00 9 V 8.13 3.79 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 0.87 0.00 0.00 1.56 0.00 0.00 10 G 8.98 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.58 3.90 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 12 G 8.09 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 13 K 8.33 3.98 0.00 1.83 1.99 0.00 1.89 0.00 0.00 1.94 0.00 0.00 3.26 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.48 7.81 14 S 7.90 4.16 0.00 4.04 4.12 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 0.00 0.00 0.00 0.00 15 T 7.92 3.84 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 16 I 7.72 3.72 2.01 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 0.53 0.96 0.00 0.00 17 S 8.59 4.15 0.00 4.04 4.20 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 18 A 8.24 4.00 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 19 E 8.22 3.87 0.00 2.18 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 2.52 2.50 0.00 20 I 7.82 3.64 1.89 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 1.43 0.88 0.88 0.00 0.00 21 S 8.14 4.01 0.00 3.96 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 22 K 7.69 3.82 0.00 2.06 1.85 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.62 7.81 23 K 7.76 4.10 0.00 1.88 1.78 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.44 7.81 24 L 8.00 4.24 0.00 1.09 0.40 0.53 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.57 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 26 Y 7.29 4.55 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 27 E 8.83 4.14 0.00 2.04 1.90 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 1.47 1.99 0.00 28 I 8.20 4.78 1.80 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 1.38 0.70 0.91 0.00 0.00 29 F 8.94 4.37 0.00 1.96 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 30 K 8.38 4.28 0.00 1.60 1.72 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.43 7.81 31 E 8.49 4.45 0.00 2.00 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 2.36 2.34 0.00 32 P 0.00 4.48 0.00 2.44 2.18 0.00 3.78 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 2.24 2.00 0.00 33 V 8.26 3.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.85 0.00 0.00 34 E 8.05 3.98 0.00 1.85 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 2.23 2.34 0.00 35 E 7.99 4.23 0.00 2.05 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 2.30 2.29 0.00 36 N 7.77 4.10 0.00 2.86 2.84 0.00 0.00 6.90 7.71 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 37 P 0.00 4.26 0.00 1.63 1.86 0.00 2.69 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.60 0.00 38 Y 8.14 4.55 0.00 3.08 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 39 F 7.87 4.10 0.00 3.19 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.36 4.06 0.00 2.19 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 2.42 2.46 0.00 41 Q 8.22 4.00 0.00 2.44 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.66 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 42 Y 8.53 4.00 0.00 2.89 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 43 Y 7.04 3.80 0.00 2.86 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 44 K 7.85 4.33 0.00 1.97 1.85 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.55 7.81 45 D 7.78 4.49 0.00 2.56 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.96 3.78 0.00 1.55 1.47 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.13 3.90 0.00 1.72 1.93 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.62 1.49 7.81 48 K 8.11 4.26 0.00 1.89 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.41 7.81 49 T 8.30 4.56 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 1.29 0.00 0.00 50 V 8.16 3.70 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 0.96 0.00 0.00 1.08 0.00 0.00 51 F 8.17 3.84 0.00 3.18 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 52 K 8.06 3.66 0.00 1.59 0.74 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.44 7.81 53 M 8.48 3.76 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.20 0.00 54 Q 8.21 3.96 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.56 0.00 0.00 0.00 0.00 0.00 2.27 2.02 0.00 55 I 7.94 3.74 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 1.40 1.12 0.96 0.00 0.00 56 Y 7.98 4.08 0.00 3.32 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.24 4.10 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.96 0.00 58 L 8.24 4.12 0.00 1.80 1.83 1.20 1.01 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 59 T 7.82 3.81 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 60 A 7.89 3.84 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.25 3.97 0.00 1.99 2.12 0.00 3.47 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 62 S 8.14 4.11 0.00 3.90 4.11 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 63 K 7.58 3.99 0.00 1.94 1.87 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.58 7.81 64 Q 8.27 4.25 0.00 2.45 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 65 L 8.31 3.95 0.00 1.72 1.85 0.78 0.50 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 66 K 7.75 4.51 0.00 1.85 1.81 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.55 7.81 67 Q 8.29 4.54 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 68 A 7.88 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.23 3.75 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.67 7.81 70 N 7.89 4.60 0.00 2.67 2.83 0.00 0.00 6.93 7.85 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 71 L 7.34 4.23 0.00 1.73 1.63 1.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.99 3.97 0.00 1.87 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 0.00 2.27 2.30 0.00 73 N 8.05 5.25 0.00 1.92 1.42 0.00 0.00 7.04 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 74 I 8.19 5.00 2.21 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.33 0.96 0.00 0.00 75 I 9.10 5.23 2.07 0.00 0.00 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 1.49 1.09 1.06 0.00 0.00 76 F 9.80 4.82 0.00 3.09 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 77 D 8.28 4.70 0.00 2.77 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 78 R 8.97 4.36 0.00 2.17 2.13 0.00 3.58 0.00 0.00 3.73 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 79 T 8.98 4.60 4.30 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 0.64 0.00 0.00 80 L 8.51 4.47 0.00 1.74 1.85 0.89 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.74 5.52 0.00 1.95 1.69 0.58 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.18 4.53 0.00 2.16 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 2.12 2.47 0.00 83 D 8.40 4.69 0.00 2.99 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 84 P 0.00 4.49 0.00 2.17 2.04 0.00 3.71 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.98 0.00 85 I 7.55 3.64 1.46 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.35 0.33 0.00 0.00 86 F 8.00 4.11 0.00 3.26 3.14 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 0.00 0.00 0.00 0.00 87 M 7.99 3.93 0.00 1.82 1.20 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 1.80 0.00 88 K 8.36 4.08 0.00 2.17 2.02 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.48 7.81 89 V 7.77 3.48 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 0.59 0.00 0.00 0.77 0.00 0.00 90 N 8.13 4.40 0.00 2.98 2.92 0.00 0.00 6.79 7.85 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 91 Y 7.68 4.44 0.00 2.85 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 92 D 7.91 4.08 0.00 2.73 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 93 L 7.69 4.35 0.00 1.61 1.67 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.57 4.24 0.00 2.80 2.85 0.00 0.00 6.93 8.54 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 95 N 8.39 4.55 0.00 2.87 2.88 0.00 0.00 6.53 8.48 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 96 V 7.54 4.50 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 1.28 0.00 0.00 1.04 0.00 0.00 97 D 8.60 4.88 0.00 3.09 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 98 Q 8.70 4.09 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.93 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 99 T 7.99 3.91 4.30 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 1.25 0.00 0.00 100 D 8.59 4.59 0.00 2.99 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 0.00 101 Y 7.98 4.08 0.00 2.78 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 0.00 102 N 8.33 4.22 0.00 3.06 2.90 0.00 0.00 7.28 6.83 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 0.00 103 T 8.62 3.90 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 104 Y 8.42 4.24 0.00 3.01 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 113 L 7.35 3.98 0.00 1.76 1.67 1.17 1.02 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 0.00 114 E 6.95 4.22 0.00 2.01 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 115 N 7.97 4.20 0.00 2.68 2.38 0.00 0.00 6.15 7.13 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 *122 K 8.58 3.89 0.00 1.69 1.73 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.75 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.40 7.81 123 L 8.18 4.24 0.00 1.28 0.78 0.21 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.84 4.44 0.00 3.87 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.37 4.38 0.00 2.93 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 0.00 126 D 8.74 4.63 0.00 2.64 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 I 7.69 4.63 1.90 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 1.35 1.29 0.99 0.00 0.00 128 V 8.68 4.32 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 0.43 0.00 0.00 0.25 0.00 0.00 129 I 9.00 4.69 2.04 0.00 0.00 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 1.47 0.72 1.09 0.00 0.00 130 Y 8.99 5.35 0.00 3.16 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 9.26 4.63 0.00 1.57 1.60 0.99 0.85 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 0.00 132 R 8.10 3.69 0.00 0.71 1.30 0.00 2.33 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.13 0.00 133 V 8.04 4.88 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 0.72 0.00 0.00 0.86 0.00 0.00 134 S 9.27 4.38 0.00 3.96 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 0.00 135 T 8.56 3.89 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 136 K 8.01 3.96 0.00 1.78 1.84 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.54 7.81 137 T 7.87 3.83 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 1.19 0.00 0.00 138 A 7.65 4.21 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 0.00 139 I 7.72 3.31 1.81 0.00 0.00 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 1.44 1.08 0.93 0.00 0.00 140 S 7.77 4.12 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 R 7.91 3.83 0.00 2.04 1.93 0.00 3.27 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 142 I 7.80 3.53 1.73 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.76 0.72 0.00 0.00 143 K 7.43 3.98 0.00 1.85 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.55 7.81 144 K 8.14 4.14 0.00 1.81 1.78 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.59 7.81 145 R 8.09 4.59 0.00 1.71 1.85 0.00 3.13 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 146 G 7.69 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 0.00 147 R 8.77 4.64 0.00 2.09 2.24 0.00 3.31 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 148 S 8.61 4.24 0.00 4.02 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 0.00 149 E 8.32 4.12 0.00 2.28 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 150 E 7.87 3.33 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 2.48 2.24 0.00 151 L 7.24 4.36 0.00 1.79 1.71 0.96 0.93 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 0.00 152 L 7.70 4.16 0.00 1.72 1.70 0.94 0.84 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 0.00 153 I 7.31 4.37 1.58 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.32 0.71 0.00 0.00 154 G 8.12 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 E 8.89 4.29 0.00 2.07 2.16 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 2.48 2.42 0.00 156 E 8.29 4.05 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 2.41 2.40 0.00 157 Y 7.69 3.85 0.00 2.74 2.40 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 0.00 158 W 7.88 4.55 0.00 3.62 3.19 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 0.00 159 E 8.33 4.01 0.00 2.20 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 2.42 2.55 0.00 160 T 7.70 3.84 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 1.12 0.00 0.00 161 L 7.72 3.82 0.00 1.51 1.83 0.49 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 162 N 8.38 4.47 0.00 3.13 2.93 0.00 0.00 7.19 6.30 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 0.00 163 K 8.23 4.03 0.00 2.05 1.86 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.67 7.81 164 N 8.54 4.39 0.00 2.74 2.79 0.00 0.00 7.10 7.40 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 0.00 165 Y 8.19 3.69 0.00 3.24 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 0.00 166 E 8.59 4.20 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 167 E 8.57 4.00 0.00 2.34 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 2.32 2.34 0.00 168 F 8.60 4.00 0.00 3.27 3.28 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 0.00 169 Y 7.88 3.71 0.00 2.35 2.99 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 0.00 170 K 7.95 3.74 0.00 1.76 1.78 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.48 1.74 7.81 171 Q 8.04 3.90 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 172 N 8.24 3.90 0.00 2.95 2.64 0.00 0.00 6.73 7.41 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 0.00 173 V 7.23 3.15 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 0.00 0.00 0.01 0.00 0.00 0.55 0.00 0.00 174 Y 6.78 4.20 0.00 1.99 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.68 4.24 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.96 4.65 0.00 2.12 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 0.00 0.00 0.00 177 P 0.00 4.75 0.00 2.18 2.27 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 178 F 8.38 5.18 0.00 3.27 3.32 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 0.00 179 F 9.45 5.03 0.00 3.17 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 0.00 180 V 8.24 4.12 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.76 0.00 0.00 181 V 8.10 4.08 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 0.83 0.00 0.00 0.80 0.00 0.00 182 D 8.56 4.39 0.00 2.66 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 8.50 4.39 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 0.00 184 E 8.49 4.00 0.00 2.04 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 2.36 2.37 0.00 185 L 7.47 4.10 0.00 1.69 1.58 0.89 1.07 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 0.00 186 D 8.38 4.55 0.00 2.93 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 8.18 3.53 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.91 0.00 0.00 188 K 8.17 3.86 0.00 1.97 1.87 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.55 7.81 189 T 8.44 3.94 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 1.21 0.00 0.00 190 Q 7.94 4.03 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.64 0.00 191 I 7.90 3.80 2.01 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 1.70 0.93 0.92 0.00 0.00 192 E 7.99 3.96 0.00 2.16 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 2.53 2.51 0.00 193 L 7.95 4.11 0.00 1.94 1.89 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.03 3.90 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.80 0.99 0.00 0.00 195 M 8.40 4.06 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.93 0.00 196 N 7.98 4.31 0.00 2.96 2.91 0.00 0.00 7.02 7.51 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 0.00 197 K 7.59 3.89 0.00 1.09 1.48 0.00 1.39 0.00 0.00 1.16 0.00 0.00 2.78 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.94 7.81 198 L 8.26 4.15 0.00 1.82 1.71 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 199 N 7.98 4.91 0.00 2.82 2.83 0.00 0.00 6.81 7.19 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 0.00 200 S 8.10 4.19 0.00 3.75 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 * Residues marked with a * may have inaccurate shift predictions.