NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3025 8.1814 115.4205 58.6544 64.2861 173.7117 5 G 3.7686 8.2161 106.5757 45.9929 0.0000 173.0927 6 G 3.6614 7.4677 109.4943 44.0501 0.0000 169.3317 7 G 3.6789 7.6208 104.9778 43.6028 0.0000 172.0160 8 L 4.9115 8.1522 121.5605 54.3346 43.1086 176.7510 9 V 4.6751 8.9354 125.3934 60.9917 35.5274 174.1750 10 K 4.8495 8.5026 125.3541 54.6347 34.5490 174.3838 11 P 4.3091 0.0000 0.0000 64.9037 31.5282 176.3442 12 A 3.8204 9.0789 126.5012 51.3568 17.9608 177.8793 13 G 4.0621 8.1960 103.8602 46.1730 0.0000 172.4048 14 S 5.2688 7.9968 113.2387 56.6862 66.4348 173.0149 15 L 4.2961 8.2578 119.5379 54.1415 45.6591 173.1094 16 K 4.7966 8.1610 124.8755 54.6975 35.2881 174.9531 17 L 4.6567 8.7879 127.6638 53.6888 44.0899 175.6053 18 S 5.6038 8.7796 116.8941 57.4322 67.2814 173.2523 19 C 4.6416 8.7231 120.1336 56.1526 46.2226 172.5174 20 A 4.9081 8.7455 129.4407 50.9938 19.1091 175.9583 21 A 4.8844 7.8249 123.5213 51.1441 20.9638 176.2476 22 S 3.9867 7.9129 112.0205 58.5981 65.0185 175.3368 23 G 3.9130 10.0048 114.1956 44.8976 0.0000 172.3953 24 F 4.5971 6.4154 112.4014 56.8142 40.1724 174.6297 25 T 4.3639 8.2605 117.5712 61.6028 66.8687 175.3685 26 F 4.0079 8.3393 128.4269 60.8859 39.9155 176.8265 27 S 4.5587 7.9491 112.7719 59.2938 63.4253 175.0079 28 S 4.4437 8.6957 116.2134 59.6847 63.2088 173.3296 29 Y 4.7731 7.7311 117.9056 56.1522 41.3452 174.2857 30 Y 4.4599 8.4817 119.1112 57.8603 39.7165 174.6603 31 M 4.9765 8.2882 122.6712 53.9529 35.4317 174.5384 32 Y 5.5085 8.5900 117.3075 56.2013 43.0581 174.6419 33 W 5.4475 9.2912 121.8374 55.2402 31.8857 174.8546 34 V 5.1434 9.4399 125.8220 60.9828 34.2112 174.6602 35 R 5.0064 9.1554 123.8811 54.3829 33.0778 174.4973 36 Q 5.0924 8.7783 120.8650 54.5098 32.0587 175.0451 37 T 4.4667 8.9454 117.5639 60.2767 69.8206 173.7298 38 P 4.4413 0.0000 0.0000 66.1160 31.0680 176.5328 39 D 4.6803 8.0821 116.7514 54.1482 40.5809 176.8756 40 K 4.0039 8.5419 116.6979 56.9180 30.4008 176.3138 41 R 4.2324 7.5966 119.0659 55.9151 30.7193 175.1877 42 L 5.2014 8.3486 121.6924 53.4799 43.4577 175.7920 43 E 4.8722 9.5252 122.3929 54.1717 33.9530 174.5973 44 W 4.7363 8.9906 133.4810 57.6130 31.0355 175.4501 45 V 3.9720 8.5170 127.3422 64.3377 31.9839 175.4966 46 A 4.3033 7.2523 118.9873 51.3357 22.6576 174.7255 47 T 5.5037 9.0864 115.8039 61.9789 73.1442 173.1926 48 I 5.0314 8.3460 123.6791 59.0227 41.2343 175.0514 49 S 2.0000 8.4086 124.1960 57.1393 63.8875 174.9507 50 D 4.7196 7.8660 119.3895 55.5634 38.8932 177.9790 51 G 3.6906 7.9425 106.2642 45.3856 0.0000 174.3475 52 G 3.9367 7.6099 106.7531 45.7041 0.0000 174.5959 53 S 4.2324 7.6807 116.8898 59.3849 63.7064 173.9923 54 Y 4.9990 7.9186 118.0936 56.1560 40.4905 175.2844 55 T 4.9920 8.0937 112.3922 60.2490 72.3263 172.7481 56 Y 5.0586 8.0590 118.7922 57.1531 42.6751 173.7751 57 Y 4.7334 8.8247 119.8224 55.5962 42.2191 173.1294 58 P 4.8816 0.0000 0.0000 62.0939 32.9406 177.0553 59 D 4.3687 8.9336 118.0133 57.7527 41.0244 179.2594 60 S 3.9557 7.8352 112.6790 61.0267 62.6125 175.2612 61 V 3.8527 7.2532 109.6512 59.9228 32.5321 175.3504 62 K 3.6461 7.5070 121.6535 58.2136 32.1021 176.9823 63 G 3.9342 8.6402 113.1749 45.7063 0.0000 173.5417 64 R 4.5130 8.3374 118.2152 57.1376 33.0702 176.0365 65 F 5.0713 8.0623 115.5057 56.7355 41.0800 176.3581 66 T 4.6337 8.3480 117.8608 62.0517 71.9185 173.0876 67 I 4.8464 9.7021 128.3810 61.1000 39.1789 174.8560 68 S 4.9378 9.0964 121.5998 58.1678 66.7729 173.0229 69 R 5.0538 8.4053 115.7729 55.5276 32.7121 174.3982 70 D 4.7883 9.1054 118.7553 52.2292 42.2254 175.5851 71 N 4.7421 9.0481 123.6103 55.8658 39.1663 177.8024 72 A 3.9833 8.2284 120.4055 55.0410 18.6732 178.2075 73 K 4.0847 8.7119 113.8265 55.9277 32.7882 176.1444 74 N 3.1400 7.9322 114.9494 54.5931 36.1045 172.7072 75 N 4.9554 6.5330 114.7053 51.0937 43.6858 174.3058 76 L 5.1814 8.6025 125.0750 53.5338 44.8673 174.6572 77 Y 5.5031 9.4358 123.1347 56.2380 42.2285 174.4899 78 L 4.4727 8.4945 122.9409 53.4980 45.3131 175.0306 79 Q 4.7425 8.5805 128.9852 54.6411 30.0274 173.5199 80 M 4.0239 8.4052 126.6469 54.4153 33.3818 175.7275 81 S 4.7538 8.1386 118.1691 57.1773 67.0898 173.9784 82 S 3.8801 8.7123 117.0071 58.9245 60.0941 172.1545 83 L 4.2011 7.6923 118.9538 55.6260 42.3159 177.3469 84 K 4.8880 9.2408 121.2781 54.1308 35.2459 177.3321 85 S 4.2996 8.6069 114.7691 61.5600 62.3036 175.5273 86 E 4.3275 8.1193 115.0970 57.5677 29.4290 176.7852 87 D 4.7536 7.9614 119.0924 55.4117 41.5208 176.7839 88 T 4.2484 7.6595 116.3752 63.7229 69.0457 173.6619 89 A 4.4299 8.3793 128.1717 52.2581 23.5627 174.6554 90 M 4.6960 8.4255 119.3529 55.0146 33.6128 175.5317 91 Y 4.9260 8.5755 120.4813 56.4392 40.9531 174.5245 92 Y 5.1816 9.3035 121.1997 56.2719 42.2242 172.0804 93 C 5.5756 8.6320 114.2109 52.7613 45.8942 172.8977 94 A 5.1495 8.0780 120.1779 51.1170 22.6612 175.2118 95 R 4.8890 9.2731 118.7488 55.1646 32.2817 175.6449 96 D 5.1468 8.6299 121.6251 52.8992 43.4044 176.0748 *106 A 3.9866 8.3236 124.2353 51.9739 18.8436 176.2899 107 M 4.3978 8.4678 122.4056 55.9422 33.0803 175.9166 108 D 4.9495 9.5695 124.4082 52.7524 42.9804 175.5316 109 Y 4.9936 9.2011 125.1861 58.5634 38.8756 176.7975 110 W 5.2813 8.3859 130.4567 57.7468 28.4666 174.2207 111 G 3.8332 7.5819 108.2142 44.5924 0.0000 173.6740 112 Q 4.4194 8.4868 121.6153 55.3046 29.6809 174.6221 113 G 3.4712 8.0285 101.6548 45.7583 0.0000 172.5742 114 T 4.7771 7.7569 126.2290 62.0654 70.4810 171.8063 115 L 4.6100 7.8358 132.6428 54.6926 43.5273 175.2491 116 V 4.7153 8.6803 126.9095 61.6585 33.8784 174.6427 117 T 4.8210 9.1516 123.9701 61.9283 71.7885 173.4044 118 V 4.7366 8.3240 128.1338 61.8893 31.5401 175.0813 119 S 4.8077 9.0401 122.3119 56.8744 65.7548 174.8116 120 A 4.0931 8.8105 127.9760 53.7759 18.6860 178.0121 121 A 3.8407 7.4932 119.1573 51.6320 18.7971 176.8973 122 K 4.5951 7.8804 119.5335 55.1229 34.4603 176.6665 123 T 4.3515 8.4928 118.7859 64.7225 69.4042 173.5159 124 T 4.8048 8.5546 119.2501 60.0071 70.9015 171.1952 125 P 4.6975 0.0000 0.0000 62.5601 32.4414 174.5254 126 P 4.9716 0.0000 0.0000 62.1653 33.7872 175.2099 127 S 4.3909 8.3788 115.4115 57.2967 66.5407 173.5939 128 V 4.5744 8.1109 124.9261 61.3408 33.1417 174.2512 129 Y 5.0560 8.5328 125.7307 55.4378 40.6203 173.8210 130 P 4.8099 0.0000 0.0000 62.9483 32.9166 176.3745 131 L 4.8002 8.6559 119.8187 52.9088 43.9526 174.3721 132 A 4.6462 8.4208 124.2686 49.7823 21.8028 175.8268 *138 V 3.7546 8.1537 119.9320 62.9309 32.6016 174.0689 139 T 4.8693 8.0609 119.3878 61.9825 71.3626 173.4128 140 L 4.6439 7.6415 127.3488 54.2537 45.3230 174.9623 141 G 4.2213 7.7438 105.7225 47.1405 0.0000 172.3297 142 C 5.4412 9.4939 116.6116 55.0630 46.2798 173.8274 143 L 4.8104 8.7226 123.2965 53.4749 44.2824 175.2506 144 V 4.6178 8.6040 127.9018 61.5432 32.6403 174.4804 145 K 4.7795 8.7565 129.5973 54.7284 35.4396 175.6810 146 G 4.0463 8.3041 113.9678 47.0856 0.0000 172.7030 147 Y 5.0174 6.8547 115.7935 55.0709 40.8990 174.9672 148 F 5.0027 8.1423 122.4543 58.8175 40.0477 173.3611 149 P 3.5419 0.0000 0.0000 62.5995 31.2074 175.7891 150 E 3.8205 8.5535 125.0177 58.4777 29.7784 175.5568 151 P 4.1531 0.0000 0.0000 63.0407 31.3824 175.4450 152 V 4.6777 7.9187 122.4326 61.1763 35.0611 174.2688 153 T 4.6236 8.5147 116.0701 59.7923 71.6932 172.6853 154 V 4.9331 8.4430 125.1412 61.1778 34.0068 174.4974 155 T 4.8208 8.5989 116.8858 59.8165 73.0318 172.5061 156 W 4.9281 8.8643 122.5805 55.3746 31.3936 176.0102 157 N 4.3163 9.3394 123.4576 55.7367 35.8290 174.4246 158 S 3.7769 9.0228 104.6520 59.5075 61.1692 174.6195 159 G 4.0870 8.3790 108.3632 45.8033 0.0000 175.7654 160 S 4.2215 8.0675 115.0512 60.5564 63.2767 174.5541 161 L 4.6152 7.5693 122.0020 53.0377 40.9290 174.3945 162 S 4.5919 8.7619 113.4307 56.1383 64.5640 171.1041 163 S 4.3545 9.9892 118.8968 58.1956 63.0848 174.2306 164 G 3.8363 8.8795 114.9351 44.8558 0.0000 172.7622 165 V 4.6333 6.9408 112.0864 60.7606 33.2542 176.5058 166 H 4.5384 8.4278 120.4855 55.0283 31.3111 171.0734 167 T 4.7906 8.0817 118.9257 62.6561 69.4415 174.0889 168 F 4.6484 9.2007 126.2287 55.3494 40.4890 174.2617 169 P 4.1843 0.0000 0.0000 62.8253 31.5216 176.0193 170 A 4.5293 8.7669 125.3288 52.6869 19.2669 176.7021 171 V 4.4885 8.7377 120.8902 59.5022 34.4161 174.6906 172 L 3.9615 8.8625 127.2939 56.0059 41.8310 176.2066 173 Q 4.0290 9.1548 128.1578 56.7388 28.2733 177.2122 174 S 4.2374 8.5859 110.7936 57.4960 65.1489 174.5145 175 D 4.4182 8.4355 121.9234 53.5689 42.5872 174.9878 176 L 4.7966 7.1428 116.9469 53.8703 46.6853 174.6069 177 Y 4.9031 8.6016 117.8667 57.0741 40.1607 175.3057 178 T 5.1836 8.2943 117.4149 62.2731 73.4108 172.6693 179 L 4.9223 8.7031 123.9593 54.3814 46.3136 173.5511 180 S 5.4792 8.8088 117.9942 56.6913 66.6448 172.5516 181 S 5.5839 9.2398 116.2119 56.7342 66.0425 172.6396 182 S 5.2867 9.3603 120.3950 55.3179 66.0972 172.9736 183 V 4.3140 7.5455 122.8656 59.9832 33.8517 174.7681 184 T 5.0656 7.9183 120.4508 61.2314 69.6648 174.0201 185 V 4.2566 7.7657 120.4843 59.6744 34.4724 175.5571 186 T 4.2979 8.1988 111.1095 61.1857 69.5811 176.0553 187 S 4.4090 8.5904 118.5109 60.6935 63.4535 175.4576 188 S 4.3733 8.0043 115.0849 60.7696 62.5645 175.4321 189 T 4.2304 7.8112 117.7078 65.4120 69.8393 176.8076 190 W 4.7340 8.6936 128.4691 59.2333 29.6514 175.0975 191 P 3.0987 0.0000 0.0000 64.7964 31.6350 177.3530 192 S 4.4244 7.2459 109.8351 58.9925 63.3249 173.7878 193 E 4.6178 8.9064 122.1028 53.9537 32.0729 174.9229 194 T 3.9690 8.7679 122.7005 64.2263 68.7414 173.3726 195 V 4.7665 8.5474 126.6770 61.6615 34.1830 174.5534 196 T 5.0049 9.1631 122.7664 62.1574 73.3591 171.8564 197 C 3.5084 8.6590 126.1554 55.1729 46.3370 171.9494 198 N 5.0096 8.5497 124.2456 50.8067 40.2338 173.2993 199 V 4.6967 8.3542 124.2774 61.1742 34.1812 174.7045 200 A 4.7251 8.6085 128.3405 50.7980 22.2268 174.9453 201 H 5.0033 9.0522 125.4205 53.6818 28.6236 173.1029 202 P 4.0080 0.0000 0.0000 65.4183 31.5849 178.9755 203 A 4.0847 7.5026 119.8447 53.8198 18.2349 178.3914 204 S 4.4611 8.4090 110.1220 58.3016 64.0272 175.1009 205 S 3.6333 7.7353 113.3588 60.9588 60.5410 171.8476 206 T 4.7198 7.2738 116.8631 61.5105 72.2492 174.7251 207 K 4.9511 8.5146 126.1167 54.8446 35.4391 175.2871 208 V 4.4652 8.8812 126.6938 61.1094 34.8711 173.6800 209 D 5.2840 8.6576 126.3137 52.4801 43.9049 174.4906 210 K 4.7287 8.5094 125.8288 54.3198 34.5320 174.7814 211 K 4.7046 8.6595 129.4896 55.4535 32.8498 176.1252 212 I 4.1564 8.3614 130.0129 61.5531 37.2963 176.2927 213 V 4.5644 8.4837 120.3603 58.7425 34.1136 174.0148 214 P 4.4143 0.0000 0.0000 62.4009 32.0967 176.7097 215 R 4.1593 8.4459 118.4150 57.1226 30.9590 175.5824 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 4 S 8.18 4.30 0.00 4.02 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 5 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 6 G 7.47 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.62 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.15 4.91 0.00 1.63 1.58 1.14 0.82 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 9 V 8.94 4.68 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.88 0.00 0.00 10 K 8.50 4.85 0.00 1.85 1.93 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.25 7.81 11 P 0.00 4.31 0.00 2.06 2.09 0.00 3.65 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 2.04 2.13 0.00 12 A 9.08 3.82 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 13 G 8.20 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.00 5.27 0.00 3.85 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.26 4.30 0.00 1.56 1.22 0.86 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.16 4.80 0.00 1.88 1.48 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.30 1.32 7.81 17 L 8.79 4.66 0.00 0.92 1.23 0.04 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.78 5.60 0.00 3.80 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 19 C 8.72 4.64 0.00 3.14 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.75 4.91 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.82 4.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.91 3.99 0.00 3.67 3.59 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 23 G 10.00 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 24 F 6.42 4.60 0.00 2.75 2.84 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 25 T 8.26 4.36 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 1.28 0.00 0.00 26 F 8.34 4.01 0.00 2.82 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 27 S 7.95 4.56 0.00 4.05 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.70 4.44 0.00 4.09 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 29 Y 7.73 4.77 0.00 2.55 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 30 Y 8.48 4.46 0.00 2.73 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 31 M 8.29 4.98 0.00 1.81 1.81 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 32 Y 8.59 5.51 0.00 2.95 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 33 W 9.29 5.45 0.00 3.44 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 34 V 9.44 5.14 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 1.34 0.00 0.00 1.02 0.00 0.00 35 R 9.16 5.01 0.00 1.19 0.83 0.00 2.49 0.00 0.00 2.82 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.00 36 Q 8.78 5.09 0.00 2.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 37 T 8.95 4.47 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 1.33 0.00 0.00 38 P 0.00 4.44 0.00 2.26 2.31 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 39 D 8.08 4.68 0.00 2.72 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 40 K 8.54 4.00 0.00 1.89 1.98 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.43 7.81 41 R 7.60 4.23 0.00 1.94 1.87 0.00 3.18 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 42 L 8.35 5.20 0.00 1.58 1.68 0.95 1.03 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 43 E 9.53 4.87 0.00 1.84 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 0.00 2.26 2.26 0.00 44 W 8.99 4.74 0.00 3.25 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 45 V 8.52 3.97 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.08 0.00 0.00 46 A 7.25 4.30 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 47 T 9.09 5.50 4.86 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 1.49 0.00 0.00 48 I 8.35 5.03 1.89 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 1.28 1.23 0.80 0.00 0.00 49 S 8.41 2.00 0.00 3.81 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 50 D 7.87 4.72 0.00 3.03 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 51 G 7.94 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 0.00 0.00 0.00 52 G 7.61 3.94 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 0.00 53 S 7.68 4.23 0.00 3.06 3.56 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 54 Y 7.92 5.00 0.00 3.01 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.09 4.99 4.04 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 1.23 0.00 0.00 56 Y 8.06 5.06 0.00 3.41 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 Y 8.82 4.73 0.00 2.78 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 58 P 0.00 4.88 0.00 2.32 2.39 0.00 3.47 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.95 0.00 59 D 8.93 4.37 0.00 2.76 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 60 S 7.84 3.96 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.25 3.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.80 0.00 0.00 62 K 7.51 3.65 0.00 1.97 1.75 0.00 2.03 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.45 7.81 63 G 8.64 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 0.00 0.00 0.00 64 R 8.34 4.51 0.00 1.77 2.29 0.00 3.06 0.00 0.00 3.02 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 65 F 8.06 5.07 0.00 2.68 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 66 T 8.35 4.63 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 1.31 0.00 0.00 67 I 9.70 4.85 2.18 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.46 0.96 0.00 0.00 68 S 9.10 4.94 0.00 4.10 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.41 5.05 0.00 2.26 2.09 0.00 3.09 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 70 D 9.11 4.79 0.00 2.88 2.55 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 71 N 9.05 4.74 0.00 2.88 2.97 0.00 0.00 6.93 7.54 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 72 A 8.23 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.71 4.08 0.00 1.69 1.80 0.00 1.98 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.39 7.81 74 N 7.93 3.14 0.00 2.75 2.34 0.00 0.00 6.70 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 6.53 4.96 0.00 2.37 1.80 0.00 0.00 6.44 6.74 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 76 L 8.60 5.18 0.00 1.99 1.55 1.08 0.16 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 77 Y 9.44 5.50 0.00 3.06 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 78 L 8.49 4.47 0.00 0.27 0.46 0.78 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.58 4.74 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.74 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 80 M 8.41 4.02 0.00 1.32 1.49 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.81 0.00 81 S 8.14 4.75 0.00 3.79 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 82 S 8.71 3.88 0.00 4.04 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 0.00 83 L 7.69 4.20 0.00 1.81 1.66 0.85 0.85 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 84 K 9.24 4.89 0.00 1.76 1.70 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.46 7.81 85 S 8.61 4.30 0.00 3.87 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 86 E 8.12 4.33 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 87 D 7.96 4.75 0.00 2.96 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 88 T 7.66 4.25 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 1.35 0.00 0.00 89 A 8.38 4.43 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 90 M 8.43 4.70 0.00 1.49 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.64 0.00 91 Y 8.58 4.93 0.00 2.86 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 92 Y 9.30 5.18 0.00 3.05 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.63 5.58 0.00 2.13 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.08 5.15 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 R 9.27 4.89 0.00 1.85 1.52 0.00 3.19 0.00 0.00 2.76 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 96 D 8.63 5.15 0.00 2.88 2.57 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 *106 A 8.32 3.99 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 M 8.47 4.40 0.00 1.85 2.02 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.33 0.00 108 D 9.57 4.95 0.00 2.74 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 0.00 109 Y 9.20 4.99 0.00 2.83 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 0.00 110 W 8.39 5.28 0.00 3.78 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.58 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 0.00 112 Q 8.49 4.42 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 113 G 8.03 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 7.76 4.78 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 1.29 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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 1.40 0.00 0.00 124 T 8.55 4.80 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 1.36 0.00 0.00 125 P 0.00 4.70 0.00 2.12 2.07 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 126 P 0.00 4.97 0.00 1.92 2.18 0.00 3.57 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 127 S 8.38 4.39 0.00 3.54 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 0.00 128 V 8.11 4.57 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 0.69 0.00 0.00 0.80 0.00 0.00 129 Y 8.53 5.06 0.00 3.00 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 0.00 130 P 0.00 4.81 0.00 2.20 2.14 0.00 3.92 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 2.10 2.10 0.00 131 L 8.66 4.80 0.00 1.82 1.65 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.42 4.65 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 *138 V 8.15 3.75 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 0.63 0.00 0.00 1.06 0.00 0.00 139 T 8.06 4.87 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 1.17 0.00 0.00 140 L 7.64 4.64 0.00 1.36 1.31 0.41 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.74 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 0.00 0.00 0.00 0.00 142 C 9.49 5.44 0.00 2.93 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 0.00 143 L 8.72 4.81 0.00 1.90 1.83 1.03 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.60 4.62 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 0.89 0.00 0.00 0.88 0.00 0.00 145 K 8.76 4.78 0.00 2.07 1.80 0.00 1.92 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.44 7.81 146 G 8.30 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 6.85 5.02 0.00 3.07 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 0.00 148 F 8.14 5.00 0.00 3.05 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 3.54 0.00 2.00 1.84 0.00 4.31 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 150 E 8.55 3.82 0.00 1.43 1.78 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 2.01 1.47 0.00 151 P 0.00 4.15 0.00 1.97 1.94 0.00 3.69 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 152 V 7.92 4.68 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 0.46 0.00 0.00 0.03 0.00 0.00 153 T 8.51 4.62 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 1.15 0.00 0.00 154 V 8.44 4.93 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 0.61 0.00 0.00 0.87 0.00 0.00 155 T 8.60 4.82 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 1.19 0.00 0.00 156 W 8.86 4.93 0.00 3.51 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 0.00 157 N 9.34 4.32 0.00 2.97 2.90 0.00 0.00 6.73 7.97 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 0.00 158 S 9.02 3.78 0.00 3.98 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 0.00 159 G 8.38 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 0.00 0.00 0.00 0.00 160 S 8.07 4.22 0.00 3.95 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 0.00 161 L 7.57 4.62 0.00 1.67 1.81 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 162 S 8.76 4.59 0.00 3.95 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 0.00 163 S 9.99 4.35 0.00 4.06 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 G 8.88 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 0.00 0.00 0.00 165 V 6.94 4.63 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 0.54 0.00 0.00 0.92 0.00 0.00 166 H 8.43 4.54 0.00 3.00 2.54 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 8.08 4.79 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 1.26 0.00 0.00 168 F 9.20 4.65 0.00 3.03 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 0.00 169 P 0.00 4.18 0.00 2.11 2.08 0.00 3.92 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 170 A 8.77 4.53 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 0.00 171 V 8.74 4.49 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 0.74 0.00 0.00 0.98 0.00 0.00 172 L 8.86 3.96 0.00 1.76 1.66 -0.13 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 173 Q 9.15 4.03 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 174 S 8.59 4.24 0.00 3.90 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 0.00 175 D 8.44 4.42 0.00 2.51 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 L 7.14 4.80 0.00 1.48 1.51 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 177 Y 8.60 4.90 0.00 1.48 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 T 8.29 5.18 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 1.34 0.00 0.00 179 L 8.70 4.92 0.00 1.91 1.75 1.07 0.93 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 0.00 180 S 8.81 5.48 0.00 3.99 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 0.00 181 S 9.24 5.58 0.00 4.09 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 9.36 5.29 0.00 4.07 4.10 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 0.00 183 V 7.55 4.31 0.67 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 -0.45 0.00 0.00 0.46 0.00 0.00 184 T 7.92 5.07 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 1.17 0.00 0.00 185 V 7.77 4.26 2.04 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 0.56 0.00 0.00 0.85 0.00 0.00 186 T 8.20 4.30 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 1.21 0.00 0.00 187 S 8.59 4.41 0.00 4.08 4.10 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 0.00 188 S 8.00 4.37 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 T 7.81 4.23 4.55 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 1.29 0.00 0.00 190 W 8.69 4.73 0.00 3.36 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 0.00 191 P 0.00 3.10 0.00 1.75 1.38 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.37 0.00 192 S 7.25 4.42 0.00 3.86 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 0.00 193 E 8.91 4.62 0.00 1.80 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 2.27 2.37 0.00 194 T 8.77 3.97 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 1.28 0.00 0.00 195 V 8.55 4.77 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 1.23 0.00 0.00 1.07 0.00 0.00 196 T 9.16 5.00 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 1.20 0.00 0.00 197 C 8.66 3.51 0.00 1.96 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 0.00 198 N 8.55 5.01 0.00 2.57 2.61 0.00 0.00 6.42 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 0.00 199 V 8.35 4.70 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 0.86 0.00 0.00 0.76 0.00 0.00 200 A 8.61 4.73 1.14 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 0.00 0.00 201 H 9.05 5.00 0.00 3.00 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 P 0.00 4.01 0.00 2.16 2.23 0.00 3.81 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 2.02 1.92 0.00 203 A 7.50 4.08 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 0.00 204 S 8.41 4.46 0.00 3.98 3.95 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 0.00 205 S 7.74 3.63 0.00 3.94 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 0.00 206 T 7.27 4.72 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 1.19 0.00 0.00 207 K 8.51 4.95 0.00 1.66 1.58 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.36 7.81 208 V 8.88 4.47 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 0.85 0.00 0.00 0.87 0.00 0.00 209 D 8.66 5.28 0.00 2.59 2.50 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 0.00 0.00 0.00 0.00 210 K 8.51 4.73 0.00 1.79 1.61 0.00 1.48 0.00 0.00 1.50 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.40 7.81 211 K 8.66 4.70 0.00 1.85 1.77 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.55 7.81 212 I 8.36 4.16 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.21 1.07 0.00 0.00 213 V 8.48 4.56 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.02 0.00 0.00 214 P 0.00 4.41 0.00 1.84 1.49 0.00 3.76 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.33 0.00 215 R 8.45 4.16 0.00 1.88 1.86 0.00 3.33 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 * Residues marked with a * may have inaccurate shift predictions.