NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.3815 8.0427 122.7550 54.9792 43.8827 175.1022 10 L 4.7326 8.2456 126.8675 53.0010 45.3836 173.5652 11 G 3.9863 10.2922 115.6171 45.5627 0.0000 171.7925 12 E 5.1571 8.8042 124.0695 54.5014 32.4085 175.4972 13 V 4.3856 8.5777 124.6655 60.8790 34.6768 173.6888 14 L 5.1142 8.5671 129.8215 53.4599 43.9025 175.7430 15 S 4.2827 8.9650 120.9432 58.1025 64.7308 173.3660 16 E 3.7603 10.1447 125.9903 57.4591 26.9561 175.6068 17 G 4.1611 8.2950 107.0402 43.8570 0.0000 173.3420 18 V 4.4542 7.8222 121.0760 61.4126 33.2369 174.4206 19 L 4.9810 9.0231 131.6977 53.9865 43.2332 174.9097 20 T 4.7666 8.5852 124.5051 62.7355 70.1819 174.0021 21 L 4.9292 9.5726 127.8267 53.5082 44.0358 175.5436 22 T 4.8491 8.9507 122.1989 61.5329 70.3696 174.3835 23 L 4.0807 8.4074 128.1165 55.0900 41.8444 177.7459 24 G 3.8776 8.3066 113.1474 45.8139 0.0000 172.4480 25 R 3.8303 8.4938 113.8098 56.9583 28.3144 176.9522 26 A 3.9602 7.6914 119.8362 52.1236 19.3756 176.1147 27 P 4.3888 0.0000 0.0000 63.7323 32.6272 177.2020 28 A 3.9028 7.9027 122.0182 53.4972 19.0053 176.6121 29 H 4.4964 7.4156 111.5470 55.3104 26.6419 173.3712 30 P 4.4437 0.0000 0.0000 62.7628 32.7219 177.9908 31 L 4.3727 8.1455 122.5343 53.5447 40.0936 176.3542 32 S 4.9104 7.6631 117.0958 56.8410 65.1357 175.2746 33 R 3.9509 8.7332 119.5815 59.5843 29.9129 178.1479 34 A 4.1271 7.8747 118.4401 52.7940 18.1076 178.9746 *36 I 4.0262 7.9597 121.6058 62.9515 39.3140 178.1040 37 A 3.9941 8.1385 121.6472 55.1373 18.1189 179.5565 38 A 3.9319 8.3020 119.4784 55.3596 18.6199 179.9068 39 L 3.9566 7.8470 117.0524 58.1537 41.7814 179.1035 40 H 4.2785 8.5868 118.5482 59.4790 29.8281 177.1597 41 D 4.3844 8.4919 120.6527 57.0557 40.4218 178.3176 42 A 4.1696 7.9237 120.1698 53.9683 18.5012 178.9754 43 L 4.1659 7.4699 118.2127 57.9377 42.4519 178.6260 44 R 4.2478 7.8810 116.7417 58.0867 30.1337 177.3155 45 R 4.1669 7.9949 118.6086 57.0061 29.7758 174.2738 46 A 3.7203 8.9013 127.9286 52.1456 18.5751 178.2710 *48 G 3.8791 7.7929 106.4311 45.8046 0.0000 172.4570 49 D 4.8788 7.4868 119.9438 52.0036 42.6804 176.6583 50 D 4.4333 8.7569 126.9503 57.7437 41.3823 177.6862 51 H 4.2582 8.2550 115.5596 57.6764 28.9891 174.7877 52 V 4.2816 7.5307 119.3523 62.0976 31.6851 174.3712 53 H 4.8475 9.4636 125.1160 56.9493 30.3453 175.8588 54 V 4.6612 7.6681 116.7574 60.9525 35.1984 173.9105 55 L 5.1618 8.9860 127.3248 53.1080 44.0377 175.4456 56 V 4.8642 8.8677 123.8581 61.1912 34.4142 174.0344 57 I 4.8472 8.9869 129.6129 60.0545 39.2684 174.0819 58 H 5.2820 9.4492 127.8895 54.3204 32.8121 172.5539 59 G 4.1277 8.8940 113.4409 42.2426 0.0000 170.7342 60 P 4.7957 0.0000 0.0000 62.4884 32.1530 177.7987 61 G 3.8521 8.7266 106.4438 44.2673 0.0000 173.7097 62 R 3.7671 8.5353 113.6200 58.3665 30.4272 176.3565 63 I 4.8469 7.1536 120.1566 59.5827 39.1346 175.5125 64 F 4.7230 9.3390 130.1538 60.2712 40.8095 174.9194 65 C 4.8635 7.6289 113.8185 58.6596 33.9754 174.4409 66 A 3.9476 9.2699 128.9334 52.5985 18.9358 174.1167 67 G 3.4634 8.6481 109.9709 45.7622 0.0000 169.2488 68 H 4.5643 8.6764 129.9963 53.9876 27.9359 174.8143 69 D 4.4577 8.7031 124.5018 54.2233 41.5399 176.7713 70 L 4.3597 8.3254 127.7774 53.3262 40.1402 174.5297 71 K 4.3595 7.9198 118.2657 55.0149 34.3168 176.2354 72 E 4.5227 8.6456 123.8739 55.0395 30.8469 176.2434 73 I 3.8907 8.1927 123.7850 62.6232 38.8866 176.2867 *83 G 3.8537 7.5931 109.0735 45.3079 0.0000 173.0089 84 R 4.0303 8.0226 121.9357 59.2241 30.0517 178.7407 85 A 3.9775 8.0534 121.4383 55.0497 18.4236 179.2344 86 F 4.0784 8.1556 118.6047 61.4614 39.6382 177.3329 87 V 3.1033 7.3779 117.1641 66.2724 31.1275 178.1660 88 T 3.9768 8.1867 115.7465 66.4932 68.2640 176.3938 89 D 4.2393 7.7796 119.7862 56.8484 41.2276 177.9670 90 L 3.4905 7.6098 121.2487 58.2058 41.9585 179.1848 91 F 4.4588 7.3707 117.4163 60.1140 38.7579 177.5083 92 E 3.9145 7.9800 119.3095 59.3330 29.5074 178.7696 93 A 4.0464 7.9786 120.8653 55.0238 18.1468 179.2691 94 C 4.0662 8.0216 116.6409 62.8800 31.8141 175.7017 95 S 4.2768 8.1967 115.4424 61.5401 62.7147 176.2688 96 A 4.2069 8.2165 123.5843 54.7595 17.9375 178.8969 97 L 3.8051 7.6595 116.4332 55.8294 41.7492 178.1261 *99 L 4.1218 7.8278 121.1885 54.7721 43.7515 178.6099 100 D 4.3867 7.8751 116.9558 57.1220 41.1882 177.6087 101 L 4.0569 8.4399 121.2048 57.9927 42.2608 178.9098 102 A 4.1914 7.8663 119.2795 54.4946 18.4696 177.5243 103 H 4.8403 7.7013 110.9781 55.6654 28.9828 174.7099 104 C 4.3211 7.7760 122.3880 58.6343 31.8355 173.0052 105 P 4.2845 0.0000 0.0000 64.9689 31.3789 176.2290 106 K 4.4604 7.1794 115.0015 54.6539 33.0809 175.5332 107 P 4.5578 0.0000 0.0000 63.6505 32.6733 175.0485 108 T 5.0843 9.0099 113.9319 60.0045 71.4554 172.7432 109 I 5.0685 9.0965 127.4795 59.2667 40.3292 174.2910 110 A 5.1162 9.0482 129.1488 50.3366 20.9650 175.4328 111 L 4.8858 9.0886 125.4021 53.6058 44.0207 175.0431 112 V 4.4977 8.6506 127.6371 61.2846 32.7677 175.8421 113 E 4.7061 9.2654 126.0452 56.1735 32.7139 175.0790 114 G 4.4665 7.6312 108.5264 45.4971 0.0000 171.7246 115 I 4.3816 8.5625 123.9454 60.3897 39.6772 175.4213 116 A 5.0278 8.8394 132.1247 50.7327 20.4857 174.6323 117 T 5.0768 8.4993 115.3810 61.1789 70.8514 174.2120 118 A 3.5510 8.8764 130.6628 53.4276 18.6758 180.6239 119 A 4.3634 8.8626 125.4874 56.1678 17.9534 179.7405 120 G 3.6795 8.0578 104.2390 47.3225 0.0000 175.6493 121 L 4.2869 7.7695 121.5126 57.8034 42.3089 178.4479 122 Q 4.1866 8.0024 119.3475 58.9169 28.6734 178.1083 123 L 4.1873 7.7357 116.6736 56.3645 41.6709 178.0395 *125 A 4.3849 7.9290 121.3519 51.8214 19.9224 178.5291 126 A 4.1965 8.2224 117.5618 53.8931 18.8471 177.2219 127 C 4.4539 7.2207 114.1948 59.0461 29.1794 173.5543 128 D 4.5896 9.2407 124.0738 57.1052 40.7988 176.9099 129 L 4.8554 8.5096 117.1750 52.8235 46.0990 175.7674 130 A 4.8987 7.6419 121.9846 50.8317 22.5829 174.6008 131 Y 5.1789 9.0775 120.0933 56.1745 41.6735 174.8277 132 A 5.9400 8.9324 123.8588 49.1211 23.6859 175.2667 133 S 5.6024 8.7553 113.4214 56.0428 65.0371 173.5621 134 P 4.4807 0.0000 0.0000 64.4849 31.2802 176.9929 135 A 4.2140 7.5738 121.1939 53.5011 19.1300 177.6580 136 A 4.1566 7.6678 118.1974 52.3929 18.8584 177.4061 137 R 4.7728 8.1292 120.6326 54.2291 34.0359 174.9333 138 F 5.3101 9.1750 120.4151 56.0744 42.7800 173.7212 139 C 4.9830 9.1034 121.8735 58.5668 35.8204 172.6540 140 L 5.0537 8.3994 122.4801 52.1216 42.7501 174.4181 141 P 4.6386 0.0000 0.0000 62.0084 32.1204 178.9118 142 G 3.8192 8.2578 107.5586 48.9145 0.0000 176.2678 143 V 3.9708 7.6740 116.0403 63.4511 31.0185 178.6235 144 Q 4.0647 7.8965 117.4898 58.4141 28.2368 177.1866 145 N 4.6420 7.9890 115.1778 53.2326 38.8275 175.5840 146 G 4.0502 8.0467 104.9734 46.0536 0.0000 174.9413 147 G 4.3215 7.7522 110.1452 44.6771 0.0000 169.5022 148 F 4.4457 8.2051 128.2627 58.6612 43.7894 175.5168 *150 T 4.6444 8.5579 112.3445 63.6716 70.1204 176.0851 151 T 3.7396 7.6391 110.7339 64.1325 69.1596 174.8090 152 P 4.3989 0.0000 0.0000 65.0602 31.4784 178.1369 153 A 4.1166 7.6654 118.7715 54.0356 17.9588 179.8297 154 V 3.4825 7.2656 116.5400 66.1404 31.6284 177.7190 155 A 4.1198 7.9126 120.0400 55.0730 18.3001 179.6196 156 V 3.5820 7.6404 117.0529 65.9757 31.4047 178.3508 157 S 4.2323 7.9106 112.6621 60.6838 62.9664 175.7831 158 R 4.2369 7.5143 119.6093 56.8961 30.2534 176.8591 159 V 4.1582 7.5501 116.6141 62.4288 33.3099 174.4459 160 I 4.6816 7.5372 111.3215 57.7355 40.7697 175.4747 161 G 3.7366 8.0661 106.7586 44.0373 0.0000 174.3613 162 R 3.8769 8.4838 120.4535 59.7995 29.9347 179.0317 163 R 3.9954 7.9676 116.7984 59.0682 29.8850 178.8072 164 A 4.2138 7.8891 119.7795 55.1426 18.5563 179.5706 165 V 3.7912 7.6539 116.6555 64.8248 31.8599 178.6531 166 T 4.1434 7.8233 116.1758 66.3400 68.2169 177.2834 167 E 4.2124 8.3393 118.8667 56.7417 29.3086 178.1607 *169 A 3.9194 7.9533 121.8381 51.5378 20.5587 179.0908 170 L 4.2712 8.3260 115.5713 57.9342 42.0618 178.7141 171 T 3.9791 8.3007 108.2203 63.4877 69.0870 176.2248 172 G 4.3134 8.2788 107.5062 44.0541 0.0000 173.1731 173 A 4.0233 7.2692 122.4851 51.9400 18.9351 177.3041 174 T 4.5923 7.8048 110.1910 61.0271 70.4480 173.7242 175 Y 4.6969 9.0868 122.1195 56.1142 41.6102 175.3673 176 D 5.1157 8.7614 122.4407 52.4697 41.5792 177.0339 177 A 4.3762 8.9491 119.8318 55.5255 18.3353 179.4584 178 D 4.3446 8.2424 116.9842 57.2692 40.8985 178.6919 179 W 4.0404 8.6537 128.5515 60.4965 30.8031 177.9776 180 A 3.7664 8.3077 120.7860 54.7207 17.7209 179.5074 181 L 3.7166 8.0691 118.8664 58.3135 42.0431 179.0197 182 A 3.7927 7.4638 119.8479 55.0670 18.3654 178.5892 183 A 3.5704 7.4612 117.2469 53.2175 18.4508 178.5982 184 G 3.7755 7.5274 103.4494 45.2255 0.0000 174.4311 185 L 3.8967 7.6447 123.1121 56.6840 42.1818 177.0976 186 I 4.4725 6.9469 109.1129 58.7332 40.5405 175.0298 187 N 4.4697 8.7425 119.7207 56.0626 38.7640 175.8143 188 R 4.8011 7.6941 115.1722 54.7994 35.3105 173.8049 189 I 4.8149 8.3661 121.5556 59.7595 39.3091 175.1758 190 L 4.8943 8.8555 126.6855 51.9177 45.6022 174.7058 191 P 4.5273 0.0000 0.0000 62.3719 31.7997 176.9247 192 E 3.9130 9.1284 122.1326 59.9337 29.0659 179.4062 193 A 3.7749 8.0500 118.8074 54.0510 19.0195 178.2070 194 A 4.4999 7.9764 117.4263 52.3294 19.8351 178.3200 195 L 3.8446 7.4739 119.2203 58.2257 41.8586 178.8041 196 A 4.1058 7.9546 120.2187 54.6252 18.3918 179.3851 197 T 3.9460 7.7441 108.3390 64.8834 69.3258 176.4874 198 H 4.0255 8.0198 120.8236 58.7472 29.7597 177.4452 199 V 3.4003 7.7642 119.8851 65.9515 31.4226 177.9661 200 A 3.9625 7.7064 120.0826 55.0556 18.0781 179.2524 201 D 4.3258 8.1359 117.4680 56.9869 41.0293 178.7836 202 L 3.8394 8.1285 121.1716 57.9965 42.0937 178.9050 203 A 4.1566 8.3538 121.2148 54.9459 18.0833 179.9041 204 G 3.5348 7.9496 103.4888 47.6846 0.0000 175.6232 205 A 4.1434 8.3464 123.4936 55.0547 17.9885 179.7713 206 L 3.9393 7.9857 117.3520 57.8314 41.4591 179.5189 207 A 4.1676 8.0313 119.3897 54.3338 18.4568 178.7635 208 A 4.2530 7.4682 117.8989 52.7614 19.0611 177.9569 209 R 4.0143 6.8629 115.6806 55.2581 30.6256 176.1514 210 N 4.4113 8.4343 117.7296 53.5998 38.6353 175.4527 211 Q 3.7937 8.7945 125.9359 58.9216 28.8430 178.4757 212 A 3.9665 7.9656 121.1406 55.0391 18.4480 177.8846 213 P 4.2893 0.0000 0.0000 65.0625 31.3888 178.7714 214 L 3.8876 7.3865 119.2676 58.2270 42.0747 179.2556 215 R 4.3239 8.0920 119.5509 58.8662 29.8814 179.1306 216 R 4.0724 8.1637 118.6703 59.1010 30.0434 178.8101 217 G 3.6443 8.1215 105.8469 47.4765 0.0000 175.6774 218 L 3.9958 8.1135 122.8933 57.6865 42.1575 178.6285 219 E 3.9081 8.2258 119.4145 59.6826 29.5365 179.0420 220 T 3.9167 7.6879 115.8573 66.3954 68.0509 176.5879 221 L 3.5846 7.9828 122.3759 58.0630 41.8614 178.8522 222 N 4.1541 7.8876 115.6016 56.1957 38.7653 177.4783 223 R 4.0300 7.7690 119.2287 59.4406 30.2044 178.6384 224 H 4.4123 8.2774 114.1459 57.6909 28.3232 176.9131 225 L 4.2797 7.2924 120.6580 56.1997 41.5138 177.0844 226 E 4.7219 7.8091 118.0432 55.7219 30.0017 175.5641 227 L 4.8668 7.4603 117.0985 51.4837 45.9074 175.5529 228 P 4.4556 0.0000 0.0000 61.8776 33.3887 177.2825 229 L 3.8224 8.5426 122.0228 58.7507 41.4149 179.1727 230 E 4.0481 8.2321 118.2673 59.3770 29.7955 178.2113 231 Q 4.2141 8.0444 116.2087 57.5056 29.1304 177.8452 232 A 4.0120 7.9134 122.5956 55.1978 18.4477 179.1992 233 Y 4.1879 8.1313 114.9851 60.8355 37.7033 178.1948 234 A 4.0893 7.5385 120.9005 54.7422 18.5254 179.1625 235 L 4.0657 7.6921 117.5844 58.2751 42.2992 178.7383 236 A 4.1878 8.1097 120.6635 55.0558 18.0339 179.7898 237 T 3.9274 7.8577 113.8641 66.5687 68.9125 174.9628 238 P 4.4512 0.0000 0.0000 64.8160 30.7905 177.9627 239 V 3.5639 7.2926 116.1673 63.2481 30.9360 177.8673 *241 V 4.0812 7.8938 119.9014 62.3535 33.0541 176.9465 242 E 3.8094 8.0355 119.6390 59.3631 29.7368 177.6353 243 H 4.4899 7.8453 114.6220 58.8895 28.8172 176.3935 244 F 4.2063 7.7266 117.0508 57.6735 38.7031 174.9456 *246 D 4.3750 7.9706 118.6355 53.4495 41.9228 174.3620 247 P 4.5639 0.0000 0.0000 61.4741 28.9730 176.6621 248 G 3.7529 7.9358 110.2441 46.2006 0.0000 170.8204 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 9 L 8.04 4.38 0.00 1.79 1.60 0.92 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.25 4.73 0.00 1.68 1.46 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 G 10.29 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 12 E 8.80 5.16 0.00 1.82 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 0.00 2.20 2.26 0.00 13 V 8.58 4.39 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 0.95 0.00 0.00 0.94 0.00 0.00 14 L 8.57 5.11 0.00 1.66 1.53 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.96 4.28 0.00 3.84 3.65 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 16 E 10.14 3.76 0.00 2.14 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 2.20 2.27 0.00 17 G 8.29 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.82 4.45 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 0.92 0.00 0.00 0.93 0.00 0.00 19 L 9.02 4.98 0.00 1.78 1.57 0.93 0.62 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 20 T 8.59 4.77 4.27 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 1.27 0.00 0.00 21 L 9.57 4.93 0.00 1.54 1.59 0.94 -0.50 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 22 T 8.95 4.85 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 1.15 0.00 0.00 23 L 8.41 4.08 0.00 1.13 1.34 0.79 0.28 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 24 G 8.31 3.88 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 0.00 0.00 0.00 25 R 8.49 3.83 0.00 1.98 1.89 0.00 3.19 0.00 0.00 3.33 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 26 A 7.69 3.96 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 27 P 0.00 4.39 0.00 2.13 2.13 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 28 A 7.90 3.90 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 29 H 7.42 4.50 0.00 3.11 3.17 0.00 5.63 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.44 0.00 2.05 1.99 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 31 L 8.15 4.37 0.00 1.71 1.57 0.88 0.62 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 32 S 7.66 4.91 0.00 4.04 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 33 R 8.73 3.95 0.00 2.13 2.13 0.00 3.17 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 34 A 7.87 4.13 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 *36 I 7.96 4.03 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 1.35 0.79 0.92 0.00 0.00 37 A 8.14 3.99 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 38 A 8.30 3.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.85 3.96 0.00 1.85 1.73 0.90 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.59 4.28 0.00 3.38 3.35 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.49 4.38 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.92 4.17 1.40 0.00 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0.00 1.57 1.72 0.00 3.03 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 138 F 9.18 5.31 0.00 3.04 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 C 9.10 4.98 0.00 3.01 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 0.00 140 L 8.40 5.05 0.00 1.53 1.41 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 141 P 0.00 4.64 0.00 2.21 2.24 0.00 3.89 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.92 0.00 142 G 8.26 3.82 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 0.00 143 V 7.67 3.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.95 0.00 0.00 144 Q 7.90 4.06 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 145 N 7.99 4.64 0.00 2.73 2.85 0.00 0.00 6.89 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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 0.00 0.00 0.00 0.00 173 A 7.27 4.02 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 0.00 174 T 7.80 4.59 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 1.16 0.00 0.00 175 Y 9.09 4.70 0.00 2.74 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 D 8.76 5.12 0.00 2.92 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 0.00 177 A 8.95 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 178 D 8.24 4.34 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 W 8.65 4.04 0.00 3.65 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 0.00 180 A 8.31 3.77 0.81 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 189 I 8.37 4.81 1.91 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 1.41 0.60 0.96 0.00 0.00 190 L 8.86 4.89 0.00 1.54 1.48 0.72 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 191 P 0.00 4.53 0.00 2.18 1.98 0.00 3.62 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 192 E 9.13 3.91 0.00 2.09 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 2.41 2.49 0.00 193 A 8.05 3.77 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 0.00 194 A 7.98 4.50 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 L 7.47 3.84 0.00 1.85 1.67 0.99 1.22 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 0.00 196 A 7.95 4.11 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 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1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 L 7.99 3.94 0.00 1.92 1.75 0.96 0.93 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 0.00 207 A 8.03 4.17 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 A 7.47 4.25 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 R 6.86 4.01 0.00 1.92 1.85 0.00 3.31 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.69 0.00 210 N 8.43 4.41 0.00 2.68 2.68 0.00 0.00 6.88 7.12 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 0.00 211 Q 8.79 3.79 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.41 1.83 0.00 212 A 7.97 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.29 0.00 2.04 1.92 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 214 L 7.39 3.89 0.00 1.68 1.84 0.90 0.93 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 0.00 215 R 8.09 4.32 0.00 1.88 1.96 0.00 3.17 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 216 R 8.16 4.07 0.00 2.08 2.17 0.00 3.18 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 217 G 8.12 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 0.00 218 L 8.11 4.00 0.00 1.87 1.67 0.96 0.86 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 0.00 219 E 8.23 3.91 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 220 T 7.69 3.92 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 1.26 0.00 0.00 221 L 7.98 3.58 0.00 1.84 1.79 0.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 222 N 7.89 4.15 0.00 2.85 2.83 0.00 0.00 7.10 7.72 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 0.00 223 R 7.77 4.03 0.00 1.97 1.94 0.00 3.10 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 224 H 8.28 4.41 0.00 3.30 3.53 0.00 5.46 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 L 7.29 4.28 0.00 1.72 1.74 0.89 0.81 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 0.00 226 E 7.81 4.72 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 227 L 7.46 4.87 0.00 1.71 1.49 0.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 228 P 0.00 4.46 0.00 2.16 1.96 0.00 3.63 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 229 L 8.54 3.82 0.00 1.71 1.75 1.03 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 230 E 8.23 4.05 0.00 2.11 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 2.41 2.44 0.00 231 Q 8.04 4.21 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 232 A 7.91 4.01 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 Y 8.13 4.19 0.00 3.15 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 A 7.54 4.09 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 7.69 4.07 0.00 1.69 1.71 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 236 A 8.11 4.19 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 T 7.86 3.93 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 1.21 0.00 0.00 238 P 0.00 4.45 0.00 2.16 2.10 0.00 3.85 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 239 V 7.29 3.56 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 0.90 0.00 0.00 0.98 0.00 0.00 *241 V 7.89 4.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.97 0.00 0.00 242 E 8.04 3.81 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 243 H 7.85 4.49 0.00 3.31 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 F 7.73 4.21 0.00 3.00 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 *246 D 7.97 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 0.00 247 P 0.00 4.56 0.00 2.08 2.01 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 248 G 7.94 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.