NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2318 8.3044 120.3385 55.4710 33.2616 174.3722 2 H 4.3131 8.7076 126.4674 54.6510 30.5516 172.7456 3 Y 4.3816 8.2629 127.6518 57.1875 40.8554 173.1488 4 Q 4.2529 8.2466 129.9359 53.4589 29.5145 172.3601 5 P 4.9066 0.0000 0.0000 59.6162 34.4851 174.8388 6 K 3.7955 8.5294 117.4422 57.4869 32.3138 177.1828 7 Q 4.0844 8.5738 122.7158 56.4305 28.7483 175.5690 8 D 4.9291 7.9103 112.6445 52.0648 40.3851 176.6419 9 L 4.0399 8.1362 123.6275 58.0606 42.2090 177.7824 10 L 4.7657 8.2310 117.6355 54.1407 42.4474 177.9113 11 N 4.2912 8.2402 119.3842 56.7317 38.7102 176.4819 12 D 5.0043 7.9088 115.4073 54.0666 41.9431 175.8559 13 R 4.7762 7.9543 118.5092 54.6605 32.5543 175.7700 14 I 4.7686 8.9791 125.7310 60.4292 38.7699 174.9767 15 I 4.8694 8.5040 127.8616 59.3780 40.8014 174.1901 16 L 4.8816 8.7830 130.0007 53.8376 43.9726 175.2522 17 V 4.9290 8.9030 126.2177 61.3465 34.2747 174.5710 18 T 4.5939 8.7883 118.4739 60.9125 70.9654 174.4058 19 G 3.8826 8.7005 108.8005 46.8815 0.0000 175.3024 20 A 4.2791 7.8299 122.5225 53.5095 18.7101 180.7749 21 S 4.1970 7.9086 111.1748 60.7087 63.3843 173.1575 22 D 4.5944 7.9158 118.1241 53.2397 45.2205 176.9711 23 G 3.7596 8.2690 111.4293 46.6925 0.0000 176.6314 24 I 3.7261 8.4230 123.5722 63.7062 36.7381 177.8162 25 G 3.8417 7.9285 107.6042 47.2039 0.0000 175.3746 26 R 4.5675 7.6314 121.7189 58.4713 30.1387 177.7170 27 E 3.9518 7.7138 117.1202 59.2593 29.8927 178.3658 28 A 3.5940 8.0406 120.7815 54.7315 18.3355 179.9613 29 A 3.9847 7.6484 115.5989 53.5306 18.4514 179.3321 *31 T 4.3027 7.8050 118.2425 65.3739 70.7889 175.7954 32 Y 4.6722 8.1155 119.1374 61.3729 37.7888 178.7797 33 A 4.3071 8.1223 121.1928 55.4449 18.3800 179.5733 34 R 4.2917 7.5078 110.8149 57.7400 30.0998 176.7696 35 Y 4.6635 8.3471 115.8307 57.7140 39.4913 176.6217 36 G 4.0060 8.5488 110.2101 45.5660 0.0000 175.0726 37 A 4.3669 7.9902 120.5528 52.6770 19.5198 178.1561 38 T 4.3917 9.1827 118.4014 62.6972 67.2256 174.1443 39 V 4.7495 8.1799 119.5787 60.3081 34.0629 174.8555 40 I 4.9220 8.6563 124.8391 59.6097 39.9942 174.4661 41 L 4.9685 9.1309 127.5458 53.4185 43.8277 175.5984 42 L 5.5568 7.8803 122.8552 52.4169 45.4278 176.0588 43 G 4.4432 8.2675 107.9199 46.6029 0.0000 173.8481 44 R 4.1167 8.8241 115.2940 58.0365 30.6603 176.8461 45 N 4.5853 7.8443 118.7141 51.9029 39.7422 174.7741 46 E 3.6750 8.6486 129.1652 59.3490 29.9291 178.1305 47 E 3.7495 8.1160 119.2336 59.0929 29.5188 178.7382 48 K 3.8637 7.9623 119.2191 59.2153 32.3423 178.6650 49 L 3.8351 7.3924 119.0320 57.1520 41.4199 179.4994 50 R 2.9952 7.5512 118.4177 58.9206 30.0121 178.6911 51 Q 3.8007 7.7320 117.7334 59.1643 28.7726 179.6034 52 V 3.4566 7.3420 118.3280 65.8393 31.5459 177.8019 53 A 4.0509 7.9235 120.4812 55.3147 18.1898 179.4955 54 S 4.0768 8.1649 111.6215 61.9381 62.4221 176.1692 55 H 4.2839 8.0983 118.7254 58.9861 28.3976 177.8339 56 I 3.7476 7.9156 121.6727 64.2307 36.7951 177.9815 57 N 4.4482 8.3151 117.9831 56.8617 38.6148 176.6875 58 E 3.9848 8.2215 118.8287 59.5461 29.6641 178.8548 59 E 4.2848 8.1823 116.9978 58.2764 29.9100 177.5377 60 T 4.5640 7.9224 105.1824 60.3769 71.7626 175.4970 61 G 4.0498 8.6460 111.4305 45.0787 0.0000 173.7225 62 R 4.4239 7.3730 115.7736 54.5507 30.8772 175.4592 63 Q 4.4530 8.4417 122.7924 54.0496 30.0004 173.4233 64 P 4.6797 0.0000 0.0000 62.5923 32.6308 175.7801 65 Q 4.3388 8.2741 120.7936 54.8820 30.2264 175.1726 66 W 5.4305 7.7478 119.2837 54.8348 31.4090 174.8123 67 F 5.0182 9.3252 118.9101 56.0249 42.8876 173.8362 68 I 4.9644 8.5377 122.7755 60.3406 38.8723 175.2814 69 L 4.2157 8.7310 125.6437 54.5390 45.7126 173.4591 70 D 4.7695 8.6335 127.1859 52.5735 41.8854 176.7839 71 L 4.0538 8.6249 127.6006 57.4520 42.0976 179.6017 72 L 4.0387 7.9175 120.4868 57.4302 42.0142 177.3821 73 T 4.6356 7.2412 102.2073 60.6128 70.0347 173.9792 74 C 4.2578 8.2132 118.0429 58.6007 30.4421 173.8088 75 T 4.4985 8.0119 112.2888 60.2136 71.9141 175.5017 76 S 4.0725 8.4013 114.1142 61.4180 62.2276 175.5523 77 E 4.3087 7.9996 122.8494 58.8867 29.4509 177.9700 78 N 4.3765 8.1686 116.5622 57.1324 38.7534 177.0009 79 C 4.1642 7.9585 117.0142 62.3771 28.1028 176.1233 80 Q 3.9931 7.7103 120.0337 58.7762 28.3700 178.1668 81 Q 4.0005 8.4688 119.5360 58.9130 28.6135 178.7946 82 L 3.7631 7.5981 121.1374 58.0427 42.1434 178.5423 83 A 3.8398 7.7687 120.3121 55.4384 18.1002 179.6124 84 Q 3.8700 8.2522 116.2701 59.2674 28.6406 178.9669 85 R 3.9626 7.8806 117.8233 59.5580 30.5623 178.8362 86 I 3.7924 7.8130 119.2519 64.3668 37.0966 178.0719 87 A 4.0413 8.1478 121.9263 55.4146 17.8726 179.9060 88 V 3.6764 7.3023 109.6723 64.9294 31.8503 178.3447 89 N 4.4172 7.9839 112.9356 54.0583 38.8990 174.9988 90 Y 4.7692 7.1748 116.1470 55.1941 41.7299 173.8902 91 P 4.4093 0.0000 0.0000 65.6885 31.9420 175.9050 92 R 4.4509 7.1732 111.8494 55.7636 31.8629 172.7193 93 L 4.6618 8.0698 116.9435 53.7925 44.8097 176.8026 94 D 4.6318 9.0369 123.4244 55.4084 42.3503 176.4503 95 G 4.3042 7.4771 103.9894 45.0518 0.0000 172.5616 96 V 4.6881 8.5773 121.6905 60.9090 35.0959 173.7155 97 L 4.8945 8.8747 131.1915 53.7869 43.5052 175.0802 98 H 4.9688 8.8842 125.6117 55.2273 28.8320 175.2265 99 N 5.4435 9.7776 121.7156 52.3316 41.2048 174.9145 100 A 4.1490 8.2721 120.7655 52.8640 18.9307 176.5752 101 G 4.2783 8.1713 108.0116 44.5154 0.0000 172.2534 102 L 4.7370 8.9418 123.1041 52.6874 44.4677 176.3737 103 L 3.5047 8.8447 128.3907 57.7379 42.2875 178.2722 104 G 3.9271 7.9392 105.6653 44.1632 0.0000 172.1013 105 D 4.1838 8.6127 118.3783 54.8852 40.8598 176.7859 106 V 4.0859 7.8050 118.4811 60.8096 31.8017 174.8429 107 C 4.6343 8.5552 119.5682 55.8784 32.6801 175.3167 108 P 4.7103 0.0000 0.0000 62.1844 32.6983 179.7462 *110 S 4.3131 8.8367 119.9046 58.7473 64.5126 174.4375 111 E 4.4075 8.0082 117.8763 55.8834 30.4332 176.0298 112 Q 3.9385 8.1073 120.1739 56.5904 29.4677 175.6369 113 N 4.6843 9.1744 123.9210 52.2217 40.2450 173.8625 114 P 4.2881 0.0000 0.0000 65.7436 31.5255 178.2558 115 Q 4.0428 8.1546 118.2521 59.3287 28.8176 178.8681 116 V 3.6093 8.0281 118.6011 65.6046 31.5112 177.3051 117 W 4.1762 8.3681 127.3518 61.0436 30.5787 177.7415 118 Q 4.3488 8.6787 116.5712 58.9482 28.4697 178.0469 119 D 4.6003 8.4807 120.5874 57.1501 40.8038 179.2141 120 V 3.6078 7.9862 116.7236 63.4745 31.3741 177.3896 *122 Q 4.2348 8.0310 119.7585 55.6764 31.0955 177.3450 123 V 3.6199 7.8264 116.6925 66.2197 31.4440 177.9128 124 N 4.5334 8.1803 114.7743 55.5444 38.6176 175.9005 125 V 4.2053 7.5528 116.6213 64.6257 33.0453 177.2408 126 N 4.4324 8.0073 115.1094 56.5546 38.8180 177.0827 127 A 4.1902 8.4123 121.0842 55.3442 18.7731 179.4147 128 T 4.0084 7.6479 113.1766 66.6420 68.4301 176.9559 129 F 4.1903 8.6070 118.8911 59.2210 39.2117 176.1781 *131 L 4.1129 7.8257 120.5293 54.8855 43.7610 178.7839 132 T 3.8935 7.8152 112.8013 64.8484 67.6897 176.0728 133 Q 3.7789 7.9784 122.0286 58.9635 29.0556 177.1979 134 A 4.0378 7.8487 118.6804 54.4621 18.7495 177.8248 135 L 4.4023 7.5601 114.2287 54.9085 43.0305 178.2358 136 L 3.8153 7.7219 120.8509 57.8519 41.9640 176.8385 137 P 4.1666 0.0000 0.0000 65.6582 31.3563 178.1578 138 L 3.9425 7.9487 116.9671 58.2683 41.2206 179.7509 139 L 4.6535 7.6491 119.4481 57.3879 41.3333 179.6007 140 L 4.0407 7.5966 117.7468 56.9568 41.6012 177.5282 141 K 4.3658 7.6924 117.4951 56.9621 32.1854 176.5215 142 S 4.8232 7.2215 111.7790 56.0542 65.2233 173.4368 143 D 4.4780 8.7051 124.0985 57.5054 40.7975 177.7824 144 A 4.5970 7.6341 119.1589 50.5792 21.0879 174.7796 145 G 3.6961 8.0672 108.8525 46.1823 0.0000 169.6731 146 S 5.1469 9.0292 119.6613 56.1341 65.2605 172.2691 147 L 5.0302 8.9247 129.1707 53.3062 44.7093 175.3692 148 V 4.9638 8.4567 118.9191 59.7129 35.7464 175.1655 149 F 5.0984 9.4930 123.1654 56.4551 42.4085 174.6519 150 T 4.9825 8.1939 117.3835 62.5216 70.2195 173.5927 151 S 5.1996 8.1896 124.7560 58.5420 65.3679 172.6606 152 S 4.7264 8.0733 109.5900 57.6383 65.1243 177.5705 153 S 4.1655 8.3364 118.8991 61.4842 62.8998 176.1646 154 V 4.7166 7.0689 111.4909 61.0961 31.1174 176.9918 155 G 3.9521 8.1131 108.4663 45.3552 0.0000 174.8376 156 R 3.9419 7.3480 117.6902 56.1956 32.7022 176.1709 157 Q 4.6838 7.6914 118.3845 54.7983 31.9265 173.1784 158 G 4.2179 8.9104 114.8520 45.0076 0.0000 172.8871 159 R 4.7824 8.4014 121.1645 53.7850 33.1138 176.4164 160 A 3.9572 8.6349 122.1477 55.9330 18.5531 178.6709 161 N 4.7162 7.9976 109.8220 53.1324 39.2232 175.6096 162 W 4.8438 7.7759 118.5588 56.4858 31.7608 177.5134 163 G 4.4276 8.5396 111.4742 44.2552 0.0000 175.2883 164 A 2.0000 9.2577 128.9751 54.7318 17.8449 179.2910 165 Y 4.0150 8.1421 118.3857 59.9751 39.0619 177.3864 166 A 4.1039 8.4560 122.3334 54.7374 18.7547 179.0411 167 A 3.8818 7.7818 119.2410 55.5734 18.0765 180.0480 168 S 4.0423 8.0984 112.7302 61.2227 63.1298 176.7536 169 K 3.9731 7.7929 121.8654 58.6565 31.7715 179.1322 170 F 3.9290 8.3868 118.1000 60.6196 38.6563 177.5394 171 A 3.9694 7.7243 118.4321 55.2397 18.1733 179.4780 172 T 3.7200 7.4256 113.4573 66.8014 68.6409 176.0600 173 E 4.1146 7.8269 118.9248 58.8061 31.1039 179.2088 174 G 3.8272 7.8683 107.3482 45.1985 0.0000 173.3313 *177 Q 4.2310 7.8407 123.0932 56.3345 31.4078 178.1832 178 V 3.5628 7.8799 116.2306 65.9921 31.9505 177.1694 179 L 4.2531 8.1249 119.0222 57.8803 41.4730 178.8240 180 A 4.0596 7.8278 120.1809 55.4672 18.6817 178.5851 181 D 4.6758 8.1226 118.4132 52.0087 38.9476 175.1473 182 E 5.5653 7.3608 133.6372 56.3207 30.6544 176.3565 183 Y 4.5395 7.6701 117.1478 55.8833 37.2024 175.4573 184 Q 4.1799 8.1445 121.8001 58.1166 29.5910 178.5673 185 Q 4.7690 7.7427 116.2484 56.1807 29.9485 176.6971 186 R 4.6133 8.1581 116.7351 56.7157 32.9813 176.0738 187 L 4.7588 7.6011 114.4000 53.5797 45.9871 175.1432 188 R 4.5697 8.5154 120.5445 55.0508 32.4905 176.1254 189 V 5.3867 8.6768 122.9722 61.4199 34.8639 173.3996 190 N 5.5064 8.8375 123.9338 52.2289 43.8753 172.9799 191 C 5.4044 8.9383 117.3425 58.3825 31.5831 173.1696 192 I 4.9828 8.4059 121.5937 59.6463 40.1435 174.3413 193 N 5.0036 9.2660 127.1013 51.4931 38.9298 173.3820 194 P 4.3114 0.0000 0.0000 64.0531 32.4173 177.9448 195 G 4.0860 8.4953 104.3315 44.3279 0.0000 172.7415 196 G 3.7947 8.5090 107.2277 46.4587 0.0000 173.1003 197 T 4.8061 8.1692 120.8581 61.3494 72.1978 174.9199 198 R 4.2478 8.3432 125.0373 55.7846 28.6078 176.1029 199 T 4.7649 7.7753 113.1751 58.3672 73.7222 174.2808 200 A 4.0056 8.4944 122.7818 55.6694 18.1859 179.6707 201 M 4.0212 7.9700 116.2167 58.5712 32.5218 178.2893 202 R 4.0012 7.9353 119.0892 59.0899 30.0190 178.1572 203 A 4.0754 7.7661 119.7516 55.6153 18.4894 179.5445 204 S 4.1495 7.8901 111.7593 61.2610 62.9665 176.0853 205 A 4.1746 7.4613 121.2780 52.0899 18.7603 177.7048 206 F 5.0088 7.7071 115.5078 55.2538 39.8985 173.5090 207 P 4.6178 0.0000 0.0000 65.5092 32.0700 178.3374 208 T 3.9929 8.3192 114.1663 66.7220 68.4789 173.7811 209 E 3.6763 7.1373 119.1704 56.2304 30.3081 175.9544 210 D 4.7339 8.5255 124.7475 52.0754 41.7767 175.0424 211 P 4.2987 0.0000 0.0000 65.5698 31.6427 178.4914 212 Q 3.9500 8.3973 118.1174 59.0250 28.9082 177.7273 213 K 4.1425 8.1882 116.4673 58.3502 32.3364 177.1576 214 L 4.5887 8.0127 118.9155 53.6871 43.0487 176.7072 215 K 4.3516 8.4866 122.7266 56.5606 34.1907 174.9482 216 T 4.9020 8.2395 116.3126 59.3020 70.3286 172.7465 217 P 4.1413 0.0000 0.0000 66.0778 31.1611 178.7391 218 A 4.0233 7.9581 117.1986 55.1947 18.3238 178.7887 219 D 4.6739 8.6159 116.5938 55.1454 41.7066 176.8647 220 I 4.3279 7.3685 113.6925 58.2058 37.4294 173.9532 *222 P 4.3343 0.0000 0.0000 63.2571 33.7311 178.8215 223 L 3.9394 7.6325 118.9597 58.5285 41.7121 178.4449 224 Y 4.0149 8.2598 114.7358 61.2813 37.8897 178.4282 225 L 4.3751 8.0040 118.4141 57.5470 41.9207 178.6948 226 W 3.9878 8.4708 127.9531 60.1763 30.6836 179.1393 227 L 3.4926 7.8819 117.8410 56.7067 42.5007 178.0684 *229 G 3.8438 8.1976 107.1628 46.0217 0.0000 172.9092 230 D 4.5543 8.3616 116.8848 55.3704 41.9341 177.7740 231 D 4.5805 8.0982 117.0347 55.7539 40.7966 176.5365 232 S 4.0553 7.1891 112.1506 57.2242 63.7384 175.2817 233 R 3.8332 7.8210 121.0124 58.2852 29.6829 176.5144 234 R 4.4904 7.6249 114.3375 56.3201 31.7517 174.8572 235 K 4.5386 8.0376 117.5947 55.9858 33.2768 175.7343 236 T 4.5870 8.3455 116.2687 62.1240 70.1186 172.9302 237 G 3.9125 9.1253 112.8815 46.4827 0.0000 173.2314 238 M 4.4990 8.4475 118.8563 53.4165 35.7255 175.3438 239 T 4.6401 7.8192 116.9341 61.8184 70.0000 173.6042 240 F 4.6519 8.5198 125.9493 57.0767 40.5234 174.4745 241 D 5.2970 8.7069 122.4691 53.0939 41.8959 176.4986 242 A 4.1011 8.8661 125.4304 54.0274 19.2343 178.4434 243 Q 4.5135 7.2211 116.7827 53.3726 28.0449 172.8639 244 P 4.2324 0.0000 0.0000 63.5661 32.3918 176.8490 245 G 3.8384 8.5519 110.7616 46.9306 0.0000 174.4972 246 R 4.1215 7.7815 120.7902 55.5563 31.1504 175.6750 247 K 4.1078 7.9524 116.5083 54.8740 31.3889 173.5505 248 P 4.2075 0.0000 0.0000 62.7484 31.6966 174.2751 249 G 3.6704 8.5173 103.7967 44.9946 0.0000 172.4686 250 I 3.5320 7.4337 117.8460 62.0316 38.5182 177.4920 251 S 4.1930 7.9756 116.2365 61.6836 63.0586 174.7154 252 Q 4.1198 7.8800 122.9672 55.6241 28.4218 175.9795 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 8.30 4.23 0.00 1.80 1.71 0.00 0.00 0.00 0.00 0.00 -2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.39 0.00 2 H 8.71 4.31 0.00 3.20 3.18 0.00 6.01 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 3 Y 8.26 4.38 0.00 2.71 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 4 Q 8.25 4.25 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 5 P 0.00 4.91 0.00 2.10 1.64 0.00 3.54 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.00 6 K 8.53 3.80 0.00 2.08 1.84 0.00 1.60 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.56 7.81 7 Q 8.57 4.08 0.00 1.75 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.11 0.00 0.00 0.00 0.00 0.00 2.03 1.16 0.00 8 D 7.91 4.93 0.00 2.82 2.80 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 9 L 8.14 4.04 0.00 1.79 2.08 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.23 4.77 0.00 1.93 1.59 0.86 0.32 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 11 N 8.24 4.29 0.00 2.98 2.89 0.00 0.00 6.90 7.98 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 12 D 7.91 5.00 0.00 2.68 2.64 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 13 R 7.95 4.78 0.00 1.83 1.75 0.00 3.33 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 14 I 8.98 4.77 1.86 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.95 0.93 0.00 0.00 15 I 8.50 4.87 1.81 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.67 0.77 0.00 0.00 16 L 8.78 4.88 0.00 1.60 1.42 0.81 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.90 4.93 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.13 0.00 0.00 18 T 8.79 4.59 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 1.24 0.00 0.00 19 G 8.70 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 20 A 7.83 4.28 1.41 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 0.00 0.00 0.00 21 S 7.91 4.20 0.00 3.85 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 22 D 7.92 4.59 0.00 2.60 2.45 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 0.00 0.00 0.00 0.00 23 G 8.27 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 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8.01 4.50 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 1.23 0.00 0.00 76 S 8.40 4.07 0.00 3.93 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 77 E 8.00 4.31 0.00 2.08 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 2.37 2.25 0.00 78 N 8.17 4.38 0.00 3.09 2.90 0.00 0.00 7.10 7.00 0.00 0.00 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 C 7.96 4.16 0.00 3.16 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 80 Q 7.71 3.99 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 81 Q 8.47 4.00 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 82 L 7.60 3.76 0.00 1.77 1.69 0.86 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.77 3.84 1.29 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 127 A 8.41 4.19 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 0.00 128 T 7.65 4.01 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 129 F 8.61 4.19 0.00 3.11 3.37 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 *131 L 7.83 4.11 0.00 1.81 1.73 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 132 T 7.82 3.89 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 1.43 0.00 0.00 133 Q 7.98 3.78 0.00 1.62 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 134 A 7.85 4.04 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 0.00 135 L 7.56 4.40 0.00 1.65 1.59 0.82 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.72 3.82 0.00 1.93 1.66 0.50 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.17 0.00 2.16 2.07 0.00 3.70 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 2.09 2.17 0.00 138 L 7.95 3.94 0.00 1.75 1.69 0.84 0.57 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 0.00 139 L 7.65 4.65 0.00 1.90 1.57 0.76 0.23 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 0.00 140 L 7.60 4.04 0.00 1.81 1.73 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.69 4.37 0.00 1.91 1.81 0.00 1.64 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.36 7.81 142 S 7.22 4.82 0.00 3.93 3.92 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 0.00 143 D 8.71 4.48 0.00 2.67 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 0.00 144 A 7.63 4.60 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 G 8.07 3.70 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 0.00 0.00 0.00 146 S 9.03 5.15 0.00 3.72 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 0.00 147 L 8.92 5.03 0.00 1.60 1.52 0.64 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.46 4.96 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 0.63 0.00 0.00 0.94 0.00 0.00 149 F 9.49 5.10 0.00 2.99 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 0.00 150 T 8.19 4.98 4.36 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 1.33 0.00 0.00 151 S 8.19 5.20 0.00 3.80 3.70 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 0.00 152 S 8.07 4.73 0.00 3.85 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 161 N 8.00 4.72 0.00 2.33 2.65 0.00 0.00 6.97 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 0.00 162 W 7.78 4.84 0.00 3.42 3.37 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 0.00 163 G 8.54 4.43 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 0.00 164 A 9.26 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Y 8.14 4.01 0.00 3.36 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 0.00 166 A 8.46 4.10 1.55 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 0.00 167 A 7.78 3.88 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 0.00 168 S 8.10 4.04 0.00 3.93 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 0.00 169 K 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0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 188 R 8.52 4.57 0.00 1.70 1.92 0.00 2.90 0.00 0.00 2.96 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 189 V 8.68 5.39 2.19 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 1.21 0.00 0.00 0.99 0.00 0.00 190 N 8.84 5.51 0.00 2.80 2.89 0.00 0.00 6.95 7.66 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 0.00 191 C 8.94 5.40 0.00 2.81 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 0.00 192 I 8.41 4.98 1.72 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.67 0.78 0.00 0.00 193 N 9.27 5.00 0.00 2.77 2.85 0.00 0.00 6.57 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 0.00 194 P 0.00 4.31 0.00 2.27 2.54 0.00 3.99 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 195 G 8.50 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 0.00 196 G 8.51 3.79 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 0.00 197 T 8.17 4.81 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 1.26 0.00 0.00 198 R 8.34 4.25 0.00 1.98 1.88 0.00 3.15 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 199 T 7.78 4.76 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 1.22 0.00 0.00 200 A 8.49 4.01 1.34 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 0.00 0.00 201 M 7.97 4.02 0.00 2.15 2.07 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 2.61 2.62 0.00 202 R 7.94 4.00 0.00 2.04 2.17 0.00 3.71 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.03 0.00 203 A 7.77 4.08 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 0.00 204 S 7.89 4.15 0.00 3.94 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 0.00 205 A 7.46 4.17 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 F 7.71 5.01 0.00 3.47 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 0.00 207 P 0.00 4.62 0.00 2.06 2.12 0.00 3.73 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 208 T 8.32 3.99 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 1.24 0.00 0.00 209 E 7.14 3.68 0.00 2.05 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 2.32 2.38 0.00 210 D 8.53 4.73 0.00 2.79 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 P 0.00 4.30 0.00 2.23 2.11 0.00 3.68 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 212 Q 8.40 3.95 0.00 2.04 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.10 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 213 K 8.19 4.14 0.00 1.91 1.84 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.67 7.81 214 L 8.01 4.59 0.00 1.69 1.60 1.03 1.24 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 0.00 215 K 8.49 4.35 0.00 1.90 1.71 0.00 1.55 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.51 7.81 216 T 8.24 4.90 4.43 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 1.25 0.00 0.00 217 P 0.00 4.14 0.00 2.13 2.02 0.00 3.64 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 2.09 2.16 0.00 218 A 7.96 4.02 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 0.00 219 D 8.62 4.67 0.00 2.92 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 0.00 220 I 7.37 4.33 2.02 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 1.62 1.01 0.96 0.00 0.00 *222 P 0.00 4.33 0.00 2.35 2.29 0.00 3.65 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 2.06 2.13 0.00 223 L 7.63 3.94 0.00 1.70 1.66 0.77 1.00 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 0.00 224 Y 8.26 4.01 0.00 3.04 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 0.00 225 L 8.00 4.38 0.00 2.03 1.93 0.53 0.44 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 0.00 226 W 8.47 3.99 0.00 2.91 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 0.00 227 L 7.88 3.49 0.00 1.71 1.59 0.77 0.90 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 *229 G 8.20 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 0.00 230 D 8.36 4.55 0.00 2.70 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 D 8.10 4.58 0.00 2.65 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 0.00 232 S 7.19 4.06 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 R 7.82 3.83 0.00 1.95 1.93 0.00 3.14 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 0.00 234 R 7.62 4.49 0.00 1.75 1.87 0.00 3.46 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 235 K 8.04 4.54 0.00 1.72 1.97 0.00 2.25 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.68 7.81 236 T 8.35 4.59 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 0.00 237 G 9.13 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 0.00 238 M 8.45 4.50 0.00 1.37 1.31 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.40 0.00 239 T 7.82 4.64 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 1.26 0.00 0.00 240 F 8.52 4.65 0.00 3.14 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 0.00 241 D 8.71 5.30 0.00 2.57 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 0.00 242 A 8.87 4.10 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 0.00 243 Q 7.22 4.51 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.93 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 244 P 0.00 4.23 0.00 2.03 1.98 0.00 3.79 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 2.01 2.25 0.00 245 G 8.55 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 0.00 246 R 7.78 4.12 0.00 1.85 1.94 0.00 3.34 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 247 K 7.95 4.11 0.00 1.96 1.85 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.44 7.81 248 P 0.00 4.21 0.00 2.06 2.06 0.00 3.65 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 2.05 2.10 0.00 249 G 8.52 3.67 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 0.00 0.00 0.00 250 I 7.43 3.53 1.80 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.61 0.85 0.00 0.00 251 S 7.98 4.19 0.00 3.95 4.01 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 0.00 252 Q 7.88 4.12 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.