NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2279 8.3027 121.7426 55.9584 31.3042 174.4231 2 K 4.4342 8.5797 127.8002 53.4457 31.5347 172.9646 3 N 4.8596 8.3977 121.7687 50.6906 40.3903 170.2353 4 V 4.7418 8.0294 121.0897 60.6152 33.7346 174.2187 5 K 4.8228 8.9619 127.6064 54.2814 35.4939 175.2595 6 E 3.8913 8.7573 125.0060 56.1004 30.3568 176.3733 7 I 3.8197 8.0368 128.9588 60.5831 36.4734 175.7832 8 T 3.8674 8.2639 122.9795 63.3560 68.0619 173.6130 9 D 4.6463 7.7263 120.0644 52.6221 43.3500 174.9139 10 A 4.9238 8.5312 129.8984 52.3966 19.5010 176.8777 11 T 3.9890 7.8984 118.8600 66.4785 69.2239 175.8763 12 K 4.6183 7.5431 122.7934 52.1452 34.4683 180.9036 13 E 4.4497 8.5906 117.3108 56.3881 30.1895 175.4167 14 P 4.4890 0.0000 0.0000 62.9282 31.7752 177.2292 15 Y 4.2429 7.4258 118.8927 60.7671 37.7138 176.7724 16 N 4.7609 8.1408 116.0866 53.2069 37.8295 176.0031 17 S 4.5508 7.9722 113.3586 58.5009 64.1885 173.4327 18 V 4.7332 7.5760 123.1113 62.1992 32.9266 175.1123 19 V 5.1233 9.0485 120.1003 59.5944 35.8017 174.2020 20 A 4.7024 9.0043 125.1502 50.5972 20.5420 177.1786 21 F 4.6510 8.9557 122.2220 56.0900 40.6768 176.8722 22 V 3.6945 8.7628 119.3408 66.1063 31.2274 177.0755 23 G 4.0696 8.0369 105.0760 45.4060 0.0000 174.6095 24 G 4.5582 7.0435 110.4088 46.2924 0.0000 172.8427 25 T 5.4822 8.8476 120.4489 61.9902 73.2374 172.9658 26 G 4.5299 9.3006 110.0348 44.9860 0.0000 171.1147 27 V 5.0666 8.7337 119.3645 60.7545 34.8346 174.7106 28 V 4.3861 9.3933 128.7925 63.1874 31.8544 176.5764 29 V 4.0888 8.8065 121.3273 62.5113 33.9153 175.5708 30 G 3.2148 7.1798 106.1672 44.0135 0.0000 170.5035 31 K 3.9373 7.8551 121.0945 57.1414 32.3367 176.8521 32 N 3.8513 9.4027 122.1322 54.0926 36.3608 173.1377 33 T 5.0006 7.9214 114.7042 61.8462 71.8775 173.0332 34 I 5.1337 9.0767 127.3868 59.4571 40.8720 174.5871 35 V 4.7942 9.0648 126.3409 61.7634 33.8640 174.6281 36 T 5.0598 8.7257 121.3125 61.2570 71.2927 172.3635 37 N 5.1222 8.6065 119.0512 52.8167 39.6347 176.8230 38 K 4.0406 9.2394 119.8854 60.0381 32.1306 179.6926 39 H 4.3374 8.2469 114.6083 58.2555 28.5149 177.5837 40 I 3.5088 7.3185 122.4186 64.1827 36.7338 177.9459 41 A 4.0909 7.3640 120.6714 54.8359 18.4121 179.6224 42 K 4.1431 8.2996 117.4999 59.6150 31.9419 179.7442 43 S 4.3155 8.0274 113.8823 61.0253 63.2276 175.9061 44 N 4.4371 7.9917 119.4529 56.3375 38.4581 176.2396 45 D 4.4920 7.8098 119.3230 56.3261 41.4380 177.2010 46 I 4.1651 7.7738 110.9568 61.5861 38.4085 176.4927 47 F 4.3411 7.8113 118.1948 56.2363 40.3167 175.2922 48 K 3.8261 7.7688 117.1513 57.3305 29.9468 174.1903 49 N 4.8393 7.9157 114.8108 52.2339 40.9473 173.9037 50 R 4.5309 8.1199 120.4318 55.8756 31.6131 176.1941 51 V 4.2389 8.4245 113.8304 59.6440 34.7981 174.8666 52 S 5.0064 8.3785 118.8342 56.4206 64.4180 172.8353 53 A 4.3599 9.0409 130.5473 52.2656 19.0321 177.3531 54 H 4.4698 8.6771 120.5257 57.0596 27.9064 174.8071 55 H 4.3020 8.0165 119.3322 56.9172 30.5649 174.1272 56 S 4.6950 8.0188 119.7243 56.7944 66.0757 174.4886 57 S 4.1917 8.5629 116.3037 61.1255 63.0579 176.0355 58 K 4.6076 7.7022 119.1063 54.4949 34.2956 182.3002 59 G 3.7659 8.2165 111.5592 47.8345 0.0000 172.9142 *60 K 3.8915 8.2023 125.5994 53.9207 29.0449 178.0927 61 G 3.8562 8.2932 113.2941 44.5637 0.0000 172.5576 62 G 3.7100 7.8181 107.8343 44.8744 0.0000 173.4408 63 G 3.6356 7.8646 106.1295 44.0974 0.0000 172.1715 64 N 5.3566 7.6205 115.3788 51.3556 40.8304 174.1406 65 Y 4.8292 8.7490 121.0385 56.0599 41.6656 175.0132 66 D 4.6654 8.7690 123.2604 54.1594 42.5955 175.4966 67 V 3.9809 8.2527 122.2852 62.7651 31.8947 175.3957 68 K 4.1800 9.1590 131.6850 58.3030 32.1008 176.5086 69 D 4.8461 7.6604 116.3910 52.3964 43.5399 172.8101 70 I 4.9723 8.2603 118.5597 59.4396 40.3503 175.3880 71 V 4.4140 8.6049 126.5508 61.2384 33.5950 174.2403 72 E 4.8907 8.8353 127.4248 55.2071 31.1733 175.3913 73 Y 3.5946 8.6403 125.0245 56.7566 39.1036 175.0760 74 P 4.0231 0.0000 0.0000 65.0316 31.8629 177.0757 75 G 3.7961 5.6287 106.2479 44.7033 0.0000 173.1121 76 K 4.1828 7.8170 116.3179 57.7891 32.4305 177.5750 77 E 4.1051 8.0000 118.8934 56.0795 30.3281 177.1307 78 D 4.7339 8.0212 123.6105 53.3139 39.2021 173.9540 79 L 4.9703 7.7902 121.3804 53.0780 45.9351 174.6443 80 A 5.4351 9.4520 128.2322 50.1414 22.7916 174.5097 81 I 4.8712 8.8634 114.9385 59.3272 40.8248 174.8008 82 V 4.7169 8.9979 123.5483 61.6396 34.7708 173.8166 83 H 5.3337 8.8020 124.9218 54.6336 30.7073 174.5933 84 V 4.6903 7.6577 114.9729 59.4492 34.4173 175.3867 85 H 4.4518 8.6621 121.5316 56.0426 28.5888 175.8143 86 E 4.1395 9.1254 121.4389 58.3391 31.1763 176.3825 87 T 4.9790 7.9350 117.7703 62.0298 69.7620 174.8065 88 S 4.4582 8.8446 122.1280 57.5263 64.1617 174.7617 89 T 4.1974 8.1778 108.6585 62.5231 68.5868 174.8814 90 E 4.2569 7.9967 121.0409 56.5858 30.5338 176.8313 91 G 4.0334 8.0322 106.6867 44.8459 0.0000 173.6526 92 L 4.1747 7.7849 120.5433 54.3485 42.2426 175.7274 93 N 5.1848 8.6751 121.6914 52.5241 40.4184 175.3287 94 F 3.7202 9.2953 128.1504 60.7836 39.4544 176.5396 95 N 4.5934 8.2591 114.7139 54.3878 38.5799 175.8570 96 K 4.2979 7.6688 116.7298 56.7240 32.5998 176.6866 97 N 4.9313 7.8277 114.0195 52.5561 40.1678 174.1286 98 V 4.6895 7.4548 109.8786 58.2785 35.1698 174.4133 99 S 4.4722 8.0943 115.1546 56.9074 65.3351 172.8955 100 Y 4.8430 7.6511 118.3172 56.9795 39.2746 175.3933 101 T 4.1473 8.5139 124.1328 63.9801 69.4863 175.2392 102 K 4.2657 8.3797 127.9822 54.2418 33.9218 175.7545 103 F 5.1921 8.1967 121.2485 57.1946 40.7356 176.4630 104 A 4.8897 8.0705 118.2428 51.7447 19.9373 174.3895 105 D 4.9698 8.1504 120.1065 51.9028 42.3164 176.0519 106 G 4.7457 8.5502 117.7025 44.5378 0.0000 176.0425 107 A 4.8549 8.2614 125.1800 50.2226 22.0792 175.9287 108 K 4.6994 8.7310 117.6346 54.0111 35.8283 176.6273 109 V 3.6266 7.9991 120.4536 64.4065 31.8462 176.1070 110 K 4.1128 9.0229 127.1955 56.1944 31.8079 175.8060 111 D 4.6382 7.5813 116.8654 54.6744 41.9982 175.7254 112 R 4.8142 8.5132 121.9008 55.9204 31.1515 175.7664 113 I 4.9121 8.8433 116.2795 59.2481 41.8880 174.0934 114 S 5.1493 8.9569 118.3741 56.7045 66.4391 173.3665 115 V 4.6316 9.2267 124.8267 61.3219 33.3135 174.2307 116 I 4.8886 7.8141 129.4155 60.0184 39.1995 175.3938 117 G 4.1068 8.1168 114.2277 47.1479 0.0000 171.8547 118 Y 5.5391 8.1278 112.3702 55.3783 38.1706 172.5018 119 P 4.3176 0.0000 0.0000 63.6241 33.2267 177.8054 120 K 3.7777 9.2642 123.2809 57.3484 30.2369 176.9393 121 G 3.3930 7.7316 105.3855 47.3757 0.0000 174.3396 122 A 3.7001 7.5672 121.6268 54.3589 18.4855 178.6247 123 Q 4.2861 7.6588 114.8051 56.9282 29.5222 177.0822 124 T 4.4376 7.8386 110.6538 60.8409 69.8578 174.8256 125 K 3.7966 8.6982 121.5499 56.1943 29.5775 179.3944 126 Y 3.7598 7.8247 111.8935 59.7150 35.4275 171.2918 127 K 4.2228 8.0246 118.2366 56.4484 33.4352 177.1464 128 M 4.0889 8.2867 122.6936 54.9579 33.8201 174.6828 129 F 5.1736 8.8762 124.0452 55.6078 43.0159 173.4857 130 E 5.1329 9.4352 123.9629 54.6061 31.8548 174.3902 131 S 5.4251 9.5135 121.6521 55.7140 65.3285 172.7189 132 T 4.9524 8.4595 117.0913 60.9096 70.8843 174.9133 133 G 4.2079 8.1487 108.1377 46.5671 0.0000 171.8327 134 T 5.2509 9.1700 116.7246 61.8004 73.4080 173.7120 135 I 4.4362 8.5440 127.0580 61.8067 37.5056 176.3775 136 N 4.6970 9.2429 124.9134 54.6586 40.2742 175.2831 137 H 4.8842 7.9918 117.9458 54.8213 33.6542 172.1848 138 I 4.7835 8.1880 125.6925 59.5477 40.1287 175.1669 139 S 4.3517 9.0006 121.5014 56.7318 65.2719 176.3013 140 G 3.9881 9.0628 121.0465 47.0276 0.0000 172.9293 141 T 4.5927 9.1321 121.0956 62.0141 68.7024 172.0755 142 F 5.5637 8.4345 124.2815 57.7585 41.6972 174.2539 143 M 5.0852 8.0749 121.1293 53.5889 35.1168 173.2226 144 E 5.0388 9.1584 121.3680 54.4861 33.1264 174.5526 145 F 5.4672 8.2018 120.0152 55.2720 41.8620 174.0028 146 D 5.3706 8.7716 118.4101 52.4586 40.0254 176.1269 147 A 4.4298 8.2747 120.7787 52.3595 19.1820 177.5823 148 Y 4.4041 8.2685 122.5806 57.8093 39.7800 175.2768 149 A 4.6203 8.0727 127.2678 50.3297 22.9009 174.7971 150 Q 4.8034 8.3734 119.7252 53.0174 33.4054 172.8236 151 P 4.6355 0.0000 0.0000 61.6042 32.5372 177.4169 152 G 4.7855 8.5750 123.3413 47.3321 0.0000 173.2745 153 N 4.8847 7.9149 117.7664 52.4917 38.7490 175.0548 154 S 4.2669 7.9554 116.5450 60.5131 62.9312 174.9831 155 G 4.3197 8.9150 113.3115 46.5312 0.0000 173.0676 156 S 4.5520 8.0300 116.8268 57.1954 63.9950 172.1270 157 P 4.4430 0.0000 0.0000 63.4583 32.2888 175.0011 158 V 4.3444 8.8797 124.2203 61.3839 33.0062 174.3617 159 L 5.2924 8.6821 128.3849 53.0821 45.1212 177.0155 160 N 4.6872 8.4472 119.7062 51.9734 39.5812 175.5347 161 S 4.3806 8.5407 111.5171 60.0157 63.3499 174.4123 162 K 4.3869 7.6302 120.1973 56.3191 32.5669 175.8334 163 H 4.2360 7.8359 113.3458 57.0379 26.7091 174.5458 164 E 4.6943 7.3146 114.8833 54.4449 31.5698 175.1039 165 L 4.7042 9.0297 125.5584 54.8747 42.3370 176.3765 166 I 3.8994 8.9136 128.7773 63.6494 38.6175 175.7376 167 G 3.5529 6.9854 106.1799 46.1842 0.0000 171.9756 168 I 5.2254 7.3816 112.3042 58.6085 41.5595 174.8616 169 L 4.8725 8.8103 126.3794 55.8801 42.6243 176.9214 170 Y 4.9009 8.7597 120.2068 57.4424 40.7969 175.3707 171 A 4.6056 7.1191 119.5036 49.9276 22.9156 175.5016 172 G 4.0793 8.4631 107.2969 44.2326 0.0000 173.0774 173 S 4.3204 7.7584 115.3912 60.0303 64.0947 173.8171 174 G 3.4791 9.2718 117.0226 46.9475 0.0000 175.6810 *177 E 3.8241 9.1187 111.8612 55.4999 32.1161 177.4035 178 S 4.5460 7.4368 116.4029 56.2024 66.3376 174.1934 179 E 4.7686 8.8333 124.0999 55.4982 32.3322 174.8126 180 K 4.6186 7.7622 119.5917 55.1845 35.4536 174.9004 181 N 4.4352 8.5553 122.0501 50.7672 42.8779 173.3075 182 F 5.0549 8.3202 119.5182 55.6738 42.0877 175.0564 183 G 4.7164 9.1421 109.0779 44.4163 0.0000 172.2823 184 V 4.2450 9.0316 122.4530 61.9487 32.0749 174.3495 185 Y 4.3762 8.6572 130.6788 57.3010 39.4001 175.4429 186 F 4.8578 7.7244 126.4144 56.6256 38.5932 175.8728 187 T 4.1543 8.2621 114.2907 60.2351 69.8876 173.9342 188 P 4.1643 0.0000 0.0000 66.7767 30.9341 179.5983 189 Q 4.0577 7.9770 118.8603 60.0950 28.1784 181.1750 190 L 4.0398 7.3848 119.9111 57.4065 41.6537 179.6531 191 K 3.3859 8.0445 118.8585 59.0410 31.6884 179.2046 192 E 3.9209 8.2021 119.0564 59.3542 29.1679 179.1795 193 F 4.2367 7.6911 119.4367 61.3377 39.8954 177.0261 194 I 3.5839 7.5108 118.9741 64.4267 36.7060 178.5194 195 Q 4.0641 7.7405 117.6433 58.8200 28.5987 178.0764 196 N 4.5691 7.7497 115.9706 54.6507 38.5983 175.4559 197 N 4.8833 7.3172 116.6728 52.7468 39.3156 173.8934 198 I 4.2670 7.4541 119.0709 60.0861 38.2592 175.7973 199 E 4.0880 8.5969 128.7105 57.0801 30.1945 177.9371 200 K 4.2530 8.2542 125.1977 55.4302 32.6115 175.2895 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 E 8.30 4.23 0.00 2.10 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 2.30 2.33 0.00 2 K 8.58 4.43 0.00 1.68 1.50 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.75 0.32 7.81 3 N 8.40 4.86 0.00 2.85 2.67 0.00 0.00 6.51 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 4 V 8.03 4.74 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.03 0.00 0.00 5 K 8.96 4.82 0.00 1.70 1.66 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.50 7.81 6 E 8.76 3.89 0.00 1.51 1.71 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 2.06 2.05 0.00 7 I 8.04 3.82 1.49 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.43 0.05 0.00 0.00 8 T 8.26 3.87 4.13 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 1.13 0.00 0.00 9 D 7.73 4.65 0.00 2.66 2.38 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 10 A 8.53 4.92 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 11 T 7.90 3.99 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 1.19 0.00 0.00 12 K 7.54 4.62 0.00 1.66 1.66 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.35 1.00 7.81 13 E 8.59 4.45 0.00 1.84 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 2.20 2.15 0.00 14 P 0.00 4.49 0.00 1.96 1.98 0.00 2.20 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.39 0.00 15 Y 7.43 4.24 0.00 3.23 2.96 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 16 N 8.14 4.76 0.00 2.67 2.99 0.00 0.00 5.95 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 17 S 7.97 4.55 0.00 4.13 4.14 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 18 V 7.58 4.73 2.34 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 1.10 0.00 0.00 1.01 0.00 0.00 19 V 9.05 5.12 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 0.95 0.00 0.00 1.15 0.00 0.00 20 A 9.00 4.70 0.39 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 21 F 8.96 4.65 0.00 2.97 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.76 3.69 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 0.76 0.00 0.00 0.86 0.00 0.00 23 G 8.04 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 0.00 0.00 0.00 24 G 7.04 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 0.00 0.00 0.00 0.00 25 T 8.85 5.48 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 26 G 9.30 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 27 V 8.73 5.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.07 0.00 0.00 28 V 9.39 4.39 2.33 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 1.22 0.00 0.00 1.14 0.00 0.00 29 V 8.81 4.09 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 0.84 0.00 0.00 0.98 0.00 0.00 30 G 7.18 3.21 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 0.00 31 K 7.86 3.94 0.00 1.63 1.86 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.51 7.81 32 N 9.40 3.85 0.00 2.90 2.80 0.00 0.00 6.86 7.05 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 33 T 7.92 5.00 4.17 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 0.00 0.00 1.19 0.00 0.00 34 I 9.08 5.13 2.03 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.98 1.24 0.00 0.00 35 V 9.06 4.79 2.24 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 1.23 0.00 0.00 0.99 0.00 0.00 36 T 8.73 5.06 4.18 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 0.99 0.00 0.00 37 N 8.61 5.12 0.00 2.75 2.81 0.00 0.00 6.87 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 38 K 9.24 4.04 0.00 2.01 1.89 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.51 1.57 7.81 39 H 8.25 4.34 0.00 3.39 3.59 0.00 5.46 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.32 3.51 1.65 0.00 0.00 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 1.18 1.20 0.22 0.00 0.00 41 A 7.36 4.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.30 4.14 0.00 1.94 1.91 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.49 1.47 7.81 43 S 8.03 4.32 0.00 4.16 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 44 N 7.99 4.44 0.00 3.15 3.03 0.00 0.00 6.69 8.37 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 45 D 7.81 4.49 0.00 2.88 2.87 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 46 I 7.77 4.17 1.83 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.86 0.93 0.00 0.00 47 F 7.81 4.34 0.00 2.95 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 48 K 7.77 3.83 0.00 1.93 1.90 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 49 N 7.92 4.84 0.00 2.75 2.72 0.00 0.00 7.29 7.65 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 50 R 8.12 4.53 0.00 1.66 1.76 0.00 3.16 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 51 V 8.42 4.24 1.56 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 -0.08 0.00 0.00 0.97 0.00 0.00 52 S 8.38 5.01 0.00 3.66 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 9.04 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 54 H 8.68 4.47 0.00 3.47 3.77 0.00 5.76 0.00 0.00 0.00 0.00 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 H 8.02 4.30 0.00 3.12 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.02 4.70 0.00 4.00 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 57 S 8.56 4.19 0.00 3.97 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 58 K 7.70 4.61 0.00 1.70 1.64 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.25 7.81 59 G 8.22 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *60 K 8.20 3.89 0.00 1.93 1.95 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.21 0.97 7.81 61 G 8.29 3.86 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 0.00 0.00 0.00 62 G 7.82 3.71 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 0.00 0.00 0.00 63 G 7.86 3.64 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 0.00 0.00 0.00 64 N 7.62 5.36 0.00 2.52 2.56 0.00 0.00 6.78 7.34 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 65 Y 8.75 4.83 0.00 2.93 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 66 D 8.77 4.67 0.00 2.79 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 67 V 8.25 3.98 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 0.81 0.00 0.00 1.07 0.00 0.00 68 K 9.16 4.18 0.00 1.49 1.67 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.22 7.81 69 D 7.66 4.85 0.00 2.73 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 70 I 8.26 4.97 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.60 0.95 0.00 0.00 71 V 8.60 4.41 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 1.21 0.00 0.00 0.95 0.00 0.00 72 E 8.84 4.89 0.00 1.93 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 2.31 2.34 0.00 73 Y 8.64 3.59 0.00 2.70 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.02 0.00 1.67 1.89 0.00 2.32 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 75 G 5.63 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.82 4.18 0.00 2.08 1.87 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.47 1.28 7.81 77 E 8.00 4.11 0.00 1.89 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 78 D 8.02 4.73 0.00 2.49 2.53 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 79 L 7.79 4.97 0.00 1.73 1.36 1.03 0.66 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 80 A 9.45 5.44 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 81 I 8.86 4.87 1.80 0.00 0.00 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 0.95 0.65 0.89 0.00 0.00 82 V 9.00 4.72 2.24 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 0.99 0.00 0.00 1.03 0.00 0.00 83 H 8.80 5.33 0.00 3.28 3.06 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.66 4.69 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 0.45 0.00 0.00 -0.19 0.00 0.00 85 H 8.66 4.45 0.00 3.08 3.26 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 9.13 4.14 0.00 2.14 2.35 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 2.39 2.40 0.00 87 T 7.93 4.98 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 1.26 0.00 0.00 88 S 8.84 4.46 0.00 3.78 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 89 T 8.18 4.20 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 1.18 0.00 0.00 90 E 8.00 4.26 0.00 1.91 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 2.18 2.21 0.00 91 G 8.03 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 92 L 7.78 4.17 0.00 1.72 1.75 0.95 0.31 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 93 N 8.68 5.18 0.00 2.79 2.73 0.00 0.00 6.84 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 94 F 9.30 3.72 0.00 2.49 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 95 N 8.26 4.59 0.00 2.95 2.98 0.00 0.00 7.07 7.60 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 96 K 7.67 4.30 0.00 1.86 1.83 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.57 7.81 97 N 7.83 4.93 0.00 2.69 2.83 0.00 0.00 6.72 7.01 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 98 V 7.45 4.69 1.86 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 0.43 0.00 0.00 0.41 0.00 0.00 99 S 8.09 4.47 0.00 3.68 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 0.00 100 Y 7.65 4.84 0.00 2.89 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 0.00 101 T 8.51 4.15 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 1.17 0.00 0.00 102 K 8.38 4.27 0.00 1.44 1.67 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.74 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 1.03 7.81 103 F 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0.00 0.00 0.00 0.00 0.00 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 R 8.51 4.81 0.00 1.69 1.86 0.00 3.32 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 113 I 8.84 4.91 1.70 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 1.16 0.79 0.86 0.00 0.00 114 S 8.96 5.15 0.00 3.72 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 0.00 115 V 9.23 4.63 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 1.08 0.00 0.00 0.73 0.00 0.00 116 I 7.81 4.89 1.92 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 1.30 0.84 1.00 0.00 0.00 117 G 8.12 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 0.00 0.00 0.00 118 Y 8.13 5.54 0.00 3.10 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 0.00 119 P 0.00 4.32 0.00 2.07 2.04 0.00 4.26 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 1.74 1.94 0.00 120 K 9.26 3.78 0.00 1.85 1.91 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.33 7.81 121 G 7.73 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 0.00 0.00 0.00 122 A 7.57 3.70 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.66 4.29 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 124 T 7.84 4.44 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 1.36 0.00 0.00 125 K 8.70 3.80 0.00 1.93 1.77 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.01 7.81 126 Y 7.82 3.76 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.02 4.22 0.00 1.73 1.45 0.00 1.82 0.00 0.00 1.95 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.63 7.81 128 M 8.29 4.09 0.00 2.01 1.71 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 129 F 8.88 5.17 0.00 3.05 2.88 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 0.00 0.00 0.00 0.00 130 E 9.44 5.13 0.00 2.07 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 0.00 2.29 2.33 0.00 131 S 9.51 5.43 0.00 3.98 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.46 4.95 4.26 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 1.24 0.00 0.00 133 G 8.15 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 0.00 0.00 0.00 134 T 9.17 5.25 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 1.29 0.00 0.00 135 I 8.54 4.44 1.90 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 1.28 0.74 1.01 0.00 0.00 136 N 9.24 4.70 0.00 2.65 2.92 0.00 0.00 6.78 8.13 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 0.00 137 H 7.99 4.88 0.00 3.32 3.27 0.00 5.80 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.19 4.78 1.62 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.65 0.20 0.00 0.00 139 S 9.00 4.35 0.00 3.86 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 0.00 140 G 9.06 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 0.00 0.00 0.00 141 T 9.13 4.59 4.32 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 1.32 0.00 0.00 142 F 8.43 5.56 0.00 3.24 3.11 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 0.00 143 M 8.07 5.09 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.63 0.00 144 E 9.16 5.04 0.00 2.19 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 2.13 2.42 0.00 145 F 8.20 5.47 0.00 3.11 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.77 5.37 0.00 2.83 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 0.00 147 A 8.27 4.43 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 0.00 148 Y 8.27 4.40 0.00 3.22 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.07 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.37 4.80 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.07 0.00 0.00 0.00 0.00 0.00 2.18 1.90 0.00 151 P 0.00 4.64 0.00 2.12 2.17 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 152 G 8.57 4.79 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 0.00 0.00 0.00 153 N 7.91 4.88 0.00 2.85 2.88 0.00 0.00 7.13 7.94 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 0.00 154 S 7.96 4.27 0.00 3.97 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 0.00 155 G 8.92 4.32 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 0.00 156 S 8.03 4.55 0.00 3.97 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 0.00 157 P 0.00 4.44 0.00 2.12 2.25 0.00 3.93 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.05 0.00 158 V 8.88 4.34 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 0.60 0.00 0.00 0.49 0.00 0.00 159 L 8.68 5.29 0.00 1.56 1.49 0.85 0.75 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 0.00 160 N 8.45 4.69 0.00 2.91 2.98 0.00 0.00 6.80 6.49 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 0.00 161 S 8.54 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 0.00 162 K 7.63 4.39 0.00 1.77 1.76 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.37 1.38 7.81 163 H 7.84 4.24 0.00 3.26 3.28 0.00 5.62 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 E 7.31 4.69 0.00 2.26 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 165 L 9.03 4.70 0.00 1.63 1.88 1.05 1.46 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 0.00 166 I 8.91 3.90 1.88 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 1.18 0.98 0.97 0.00 0.00 167 G 6.99 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 I 7.38 5.23 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.41 1.06 0.00 0.00 169 L 8.81 4.87 0.00 1.94 1.85 1.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 170 Y 8.76 4.90 0.00 3.28 3.05 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 0.00 171 A 7.12 4.61 0.94 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 0.00 0.00 172 G 8.46 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 0.00 0.00 0.00 173 S 7.76 4.32 0.00 3.96 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 G 9.27 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *177 E 9.12 3.82 0.00 2.03 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 2.13 1.88 0.00 178 S 7.44 4.55 0.00 3.79 3.51 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 0.00 179 E 8.83 4.77 0.00 1.94 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 2.54 2.55 0.00 180 K 7.76 4.62 0.00 1.65 1.77 0.00 1.44 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.26 7.81 181 N 8.56 4.44 0.00 1.69 2.12 0.00 0.00 6.39 7.68 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 0.00 182 F 8.32 5.05 0.00 2.34 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 0.00 183 G 9.14 4.72 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 0.00 184 V 9.03 4.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.92 0.00 0.00 185 Y 8.66 4.38 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.72 4.86 0.00 2.76 2.56 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 0.00 187 T 8.26 4.15 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 1.42 0.00 0.00 188 P 0.00 4.16 0.00 2.17 2.15 0.00 3.62 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 189 Q 7.98 4.06 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.02 0.00 190 L 7.38 4.04 0.00 1.79 1.31 0.94 -0.21 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 0.00 191 K 8.04 3.39 0.00 1.70 1.48 0.00 1.47 0.00 0.00 1.34 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.30 1.17 7.81 192 E 8.20 3.92 0.00 2.26 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 2.31 2.46 0.00 193 F 7.69 4.24 0.00 3.07 3.21 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 0.00 194 I 7.51 3.58 1.72 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.98 0.97 0.00 0.00 195 Q 7.74 4.06 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 196 N 7.75 4.57 0.00 2.68 2.81 0.00 0.00 6.84 8.60 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 0.00 197 N 7.32 4.88 0.00 2.33 2.59 0.00 0.00 6.95 6.84 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 0.00 198 I 7.45 4.27 1.79 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 1.25 0.63 0.77 0.00 0.00 199 E 8.60 4.09 0.00 2.08 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 2.12 2.04 0.00 200 K 8.25 4.25 0.00 1.48 1.49 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 0.98 7.81 * Residues marked with a * may have inaccurate shift predictions.