NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2309 7.8827 121.4551 61.1983 38.7573 173.7887 17 V 4.3360 9.0497 125.7830 61.9604 32.9336 173.6508 18 G 3.9937 8.7294 116.0368 45.1550 0.0000 172.0074 19 G 3.7553 9.1792 110.1693 46.2792 0.0000 171.7192 20 Q 4.5927 8.2287 118.3271 55.0893 32.6234 173.9622 21 E 4.5007 8.5617 119.2864 56.2832 30.1577 178.0003 22 C 4.5532 8.4613 121.7186 56.8735 36.1210 174.1555 23 K 4.2539 9.8104 123.4359 55.1453 32.7616 176.0305 24 D 4.4152 8.4800 119.7414 55.9179 41.3598 175.7459 25 G 3.9020 9.9878 113.3956 46.3956 0.0000 173.9809 26 E 4.0395 7.7985 121.5243 57.0280 30.8717 175.7490 27 C 4.2210 7.1424 114.4156 54.7757 39.7963 173.2375 28 P 3.9478 0.0000 0.0000 63.9644 31.8073 178.0368 29 W 4.8765 6.2144 115.4318 55.6739 28.3264 174.6058 30 Q 4.8039 7.5832 121.3570 55.7189 28.9572 174.9800 31 A 4.8879 8.3738 128.0592 50.3440 22.3340 175.3448 32 L 4.5865 8.4157 120.2491 53.7679 45.8675 174.7435 33 L 5.1545 9.0875 127.4832 53.2245 42.9929 175.6452 34 I 5.0406 8.3351 117.8352 59.2309 40.5355 176.1025 35 N 5.2970 9.1690 123.3695 52.0951 39.3832 174.9714 36 E 3.9776 8.8374 114.7947 59.8162 29.9511 177.1152 37 E 4.4078 8.8816 118.3511 55.7844 29.4343 176.2024 38 N 4.1750 8.0218 113.6987 54.1381 37.0469 173.7609 39 E 4.3739 7.9934 117.4420 54.7804 30.1797 176.4423 40 G 3.9203 8.6650 114.0591 45.7890 0.0000 172.6105 41 F 5.0444 8.9530 117.4502 56.5598 39.6200 173.9898 42 C 4.6891 7.3014 115.3675 56.1717 44.6652 173.1896 43 G 4.1974 8.7655 109.3440 45.4038 0.0000 171.9808 44 G 4.5012 8.0034 105.2877 45.6023 0.0000 172.0222 45 T 5.2116 8.9652 116.0428 61.4256 72.3252 174.1962 46 I 4.1489 8.8496 128.4944 61.9096 37.4167 177.0462 47 L 4.4141 8.7439 127.6785 56.1760 42.7282 176.2124 48 S 4.8607 7.5665 110.1352 57.9189 65.1428 174.4215 49 E 3.9353 8.9656 116.8912 58.3502 29.6717 177.7665 50 F 4.2170 8.7475 117.3059 57.4147 42.5105 174.5099 51 Y 5.2552 8.3401 115.4818 56.2234 40.9989 174.8746 52 I 5.1168 8.5438 122.8948 59.5011 40.8854 174.3339 53 L 4.9276 9.1762 129.9706 54.8894 43.7041 175.3798 54 T 5.0127 8.8793 119.2519 61.0230 71.7673 172.0197 55 A 4.4284 8.2317 125.2605 50.8776 20.0512 178.4147 56 A 3.6240 8.0072 123.2093 55.1936 18.4895 180.1241 57 H 4.2148 7.7463 113.6210 58.8018 28.1384 177.0391 58 C 4.5157 7.2339 118.3999 59.2328 40.0755 175.2203 59 L 4.0629 7.5476 119.5253 56.1849 41.1222 176.9293 60 Y 5.0284 7.5186 116.2861 58.0710 38.5439 175.8526 61 Q 4.5617 7.9286 115.3919 54.8905 30.2746 175.0823 61A A 4.1268 7.4257 116.1152 51.2759 21.7256 177.7400 62 K 4.1852 8.8637 122.8677 59.0058 32.4957 178.1484 63 R 4.5327 7.8916 116.9518 54.4702 33.9958 174.0911 64 F 5.4587 8.0020 116.3128 55.4091 42.0094 173.1994 65 K 4.9411 9.0460 117.9366 54.7855 36.9202 174.8924 66 V 4.7276 8.7417 120.0567 61.5815 34.2417 174.3289 67 R 5.6163 9.3571 129.8533 54.1870 31.9634 175.3566 68 V 4.6531 8.2947 118.4615 60.5578 35.4368 177.1242 69 G 4.0182 9.0762 109.3826 45.9615 0.0000 173.8500 70 D 4.5195 7.8403 119.2284 54.5252 41.8624 175.5714 71 R 4.8443 8.7604 121.6842 55.7037 33.1274 174.3123 72 N 5.0895 8.6625 119.1759 52.7684 40.6603 174.6063 73 T 3.8480 9.1676 118.9123 64.9581 68.8626 176.0173 74 E 4.0792 8.8430 121.3956 58.9193 29.8069 176.7184 75 Q 4.4620 7.4021 113.4893 54.6199 30.4314 177.0112 76 E 4.3668 8.4957 124.7801 54.8736 28.2827 176.3140 77 E 3.9790 7.9825 119.7858 58.2774 31.0207 178.0882 78 G 3.7848 8.4157 104.3684 43.9333 0.0000 174.5868 79 G 4.0045 8.7606 111.7748 46.0280 0.0000 171.8762 80 E 5.0068 7.4365 116.3894 54.8112 32.7857 174.7529 81 A 4.5260 8.3884 117.9981 51.1529 23.0976 175.5291 82 V 4.7784 8.3328 120.3822 61.4403 33.6471 174.5358 83 H 5.0343 9.2237 124.8999 53.9947 32.2344 172.9018 84 E 4.5877 8.6124 121.2943 55.4060 31.2481 175.7715 85 V 4.0189 8.3241 124.5052 62.9723 31.4702 175.2709 86 E 4.2546 9.0852 130.6737 58.8481 29.9907 177.2148 87 V 4.5921 7.5853 117.3287 59.9138 35.4431 173.7227 88 V 4.7244 8.4370 121.6938 61.5379 33.9053 175.2149 89 I 4.4479 9.3549 130.3621 59.6939 37.6576 174.5773 90 K 4.7140 8.4567 127.4987 55.0193 34.1349 175.4918 91 H 4.3013 8.4421 125.6363 55.9060 29.6455 175.9324 92 N 4.5660 9.1278 125.2811 55.0653 37.0350 175.4547 93 R 4.2034 7.7861 116.2710 55.4171 30.6813 175.7654 94 F 4.7015 8.4481 121.5398 59.1162 39.7659 174.6697 95 T 4.1684 8.4211 124.4244 61.1140 69.4074 174.8822 96 K 3.3563 7.9994 126.9943 59.4830 32.6676 178.0464 97 E 4.0059 8.0566 119.5228 58.2365 29.8359 176.9902 98 T 4.0798 7.7286 106.4343 61.3174 70.0127 174.8099 99 Y 3.9920 8.8590 118.7039 58.6262 35.9033 168.9109 100 D 4.6437 8.0610 119.1601 55.0736 42.0137 175.4070 101 F 3.7215 8.3007 118.9421 58.7217 36.6099 176.5279 102 D 4.4337 7.9484 119.6699 52.6995 38.8920 174.5507 103 I 4.6180 7.0043 120.6214 59.4139 42.1787 172.7220 104 A 4.9620 9.2706 128.0826 51.2681 23.5102 175.2094 105 V 4.9904 8.8749 117.9013 61.4599 35.4930 173.8286 106 L 5.1313 9.0163 127.4632 52.9873 44.6383 175.3859 107 R 4.1126 9.0956 125.6292 54.7667 30.8388 175.8494 108 L 4.5502 9.0103 127.6516 54.8766 41.9192 177.6271 109 K 4.3418 9.1695 123.9276 58.6154 32.8099 177.4385 110 T 4.7063 7.7296 108.3366 58.6286 71.2024 171.6475 111 P 3.5064 0.0000 0.0000 62.0281 31.7394 176.3703 112 I 3.5248 8.4392 127.1197 61.8723 37.8334 176.3573 113 T 4.1337 8.2187 123.2918 61.4799 68.6239 174.4080 114 F 4.6957 7.9479 125.2131 58.1936 39.8113 175.3297 115 R 4.4054 8.8470 119.2147 55.6914 32.3542 173.1249 116 M 4.0306 8.5816 117.5180 57.8138 32.0705 176.1275 117 N 4.3772 9.4791 121.9608 53.2448 36.4710 174.0013 118 V 4.5992 8.2431 118.2533 61.2896 32.7788 173.2654 119 A 4.4690 8.4252 127.4557 49.4646 22.9325 173.5437 120 P 5.0604 0.0000 0.0000 62.4211 32.9258 175.0541 121 A 4.4485 8.0723 121.8669 50.1280 20.9788 176.8020 122 C 4.3439 8.0988 118.6042 59.6756 29.7147 172.8658 123 L 4.9080 8.4295 122.0714 52.5295 42.7142 175.1967 124 P 4.6443 0.0000 0.0000 61.9001 32.8460 175.5391 124A E 4.3781 8.4842 117.8522 55.7593 31.2666 176.7288 125 R 3.7213 8.7537 123.1048 60.5477 29.6932 177.8011 126 D 4.3429 8.0243 117.2965 57.3516 41.0621 178.8571 127 W 3.7812 8.1585 127.9855 60.0064 30.6378 177.7992 128 A 3.4195 8.2267 121.0342 55.1778 17.6874 179.4183 129 E 3.6375 7.6185 115.2968 58.9362 29.4738 178.9672 130 S 4.2794 7.0207 112.3856 59.7566 64.1507 175.7405 131 T 3.8500 7.0061 117.0386 63.2574 69.0372 175.5322 131A L 4.2225 7.0273 119.1875 56.4307 43.1839 178.5878 131B M 3.2771 7.4679 115.7851 57.1580 31.9393 177.1269 132 T 3.9742 7.0290 107.0527 61.4521 69.6969 174.7986 133 Q 4.1462 7.3186 122.0034 55.5512 29.6682 176.3486 134 K 4.1453 8.6035 120.3855 59.3148 32.4365 176.1458 135 T 5.0437 7.6755 106.1064 60.3865 72.6397 172.3749 136 G 4.1110 8.5025 107.5897 44.8049 0.0000 171.2135 137 I 5.2928 9.0033 120.4115 59.3213 40.6850 175.4202 138 V 5.5132 9.0586 126.9837 59.1392 34.0813 174.9170 139 S 5.0490 9.4029 116.8258 55.9697 66.9521 172.7346 140 G 4.0109 7.5334 107.5406 46.3017 0.0000 172.6274 141 F 4.6007 8.4931 115.7856 57.3284 39.8008 178.8078 142 G 4.0932 9.1770 108.8316 46.3936 0.0000 172.9561 143 R 5.0440 8.2581 119.1813 55.8043 31.4919 177.6956 144 T 4.9127 8.4160 111.8645 62.1528 69.2964 173.7521 145 H 4.4999 7.6735 119.3216 55.4381 33.4435 173.0313 146 E 4.0358 8.7384 125.0982 59.1214 29.4262 178.0879 147 K 4.0478 8.1720 117.5799 58.1825 32.9027 175.6773 *149 G 4.0002 7.6041 103.9204 46.0938 0.0000 171.6817 150 R 4.8519 8.1607 115.2590 53.9072 32.9200 175.3454 151 Q 4.6697 8.5805 118.5698 55.8901 29.1235 177.1159 152 S 4.3342 8.8243 118.5674 58.9418 63.6056 174.6688 153 T 4.2095 8.7310 117.8807 66.1971 69.2773 174.7528 154 R 5.2425 7.7341 117.4165 53.5888 33.7512 175.8000 155 L 2.8575 8.2028 123.3517 55.1651 43.1366 176.1547 156 K 5.0786 8.3784 124.3216 54.8026 36.5666 174.4540 157 M 5.3042 9.2785 118.0826 54.3470 35.3967 173.6322 158 L 4.7350 8.7024 119.5784 54.0045 46.3131 173.3857 159 E 4.8306 8.9139 127.2696 55.2978 30.8662 175.3194 160 V 4.2272 8.3094 120.9525 58.6018 34.3887 173.8200 161 P 4.6918 0.0000 0.0000 62.6935 32.4737 175.5205 162 Y 4.3991 8.5791 121.4569 58.0654 38.4957 175.3828 163 V 4.4361 7.9423 123.2620 60.7052 34.2083 175.1215 164 D 4.4880 8.4715 126.1036 52.8100 40.5307 176.7085 165 R 3.8421 8.8613 122.9143 60.1062 29.8334 177.8638 166 N 4.3403 8.2660 115.1732 56.9094 38.3590 177.2080 167 S 4.1616 8.3239 115.0392 61.7439 63.2405 175.7988 168 C 4.4645 8.5834 121.3563 59.9062 41.0074 175.9021 169 K 3.9659 8.8346 120.4493 59.3457 31.4460 178.9387 170 L 4.1239 8.3214 119.7245 56.9525 42.0953 178.0098 171 S 4.5351 7.8053 112.4561 58.6058 64.2076 174.3656 172 S 4.7083 7.1783 116.7152 58.0829 62.8260 173.7480 173 S 4.4695 8.8453 121.3503 58.2462 63.1518 174.1207 174 F 4.9536 7.6926 118.5245 54.9486 42.3100 174.7214 175 I 3.8056 8.4967 123.1823 61.3187 38.3078 175.8266 176 I 4.4568 8.2273 128.3580 59.7512 37.3400 175.6358 177 T 4.3523 8.1923 116.0787 60.7839 69.7169 175.8217 178 Q 4.1981 8.4734 120.0084 58.1233 28.9878 176.6793 179 N 4.8723 7.9209 116.2114 53.3945 38.5897 174.0510 180 M 5.9281 7.9756 116.3876 53.4493 36.7175 174.1333 181 F 4.9977 8.1766 113.2219 56.4663 41.3131 173.7577 182 C 5.3353 8.7590 116.7021 56.0706 38.2709 172.6570 183 A 4.4630 7.9522 119.3641 50.9787 22.5713 176.3016 184 G 3.6945 7.3310 110.9873 44.8925 0.0000 172.0394 185 Y 4.9704 8.1216 119.2521 56.0781 40.9806 174.9569 185A D 3.9910 8.8113 122.1075 56.4375 41.7892 177.7208 185B T 4.4541 7.5354 107.8362 61.0517 70.5801 174.4716 186 K 3.9201 8.0304 124.2379 56.4782 32.9449 177.9279 187 Q 4.4287 8.3680 128.0058 55.6639 27.2087 176.0353 188 E 4.9830 7.4496 115.5000 54.7237 34.3590 176.0942 189 D 4.4778 8.5275 121.3807 54.5545 46.4002 174.6514 190 A 4.6926 8.4566 122.3017 51.6270 21.0746 176.1643 191 C 4.6812 8.7137 116.4007 55.8349 41.4307 172.8875 192 Q 4.2730 8.4483 120.1959 57.6812 28.5225 177.5001 193 G 4.1660 9.1387 110.4271 46.0672 0.0000 174.3651 194 D 4.6033 8.5270 118.8930 55.5465 41.7205 176.8375 195 S 4.4081 7.9727 115.4778 60.4176 63.4004 175.2773 196 G 4.0952 9.7187 113.5439 45.3715 0.0000 173.7440 197 G 4.3726 7.9614 107.5271 45.1841 0.0000 171.0468 198 P 4.9604 0.0000 0.0000 62.7146 33.2487 175.0060 199 H 4.9604 8.9891 120.9813 54.6300 32.6381 172.1264 200 V 4.9256 9.1693 126.5652 61.3462 35.0178 174.2315 201 T 4.9839 8.6762 122.2552 61.7928 71.9347 172.8299 202 R 4.6587 8.7364 126.5250 55.0335 31.7903 175.3932 203 F 4.6470 8.9345 127.5710 57.3351 42.1469 174.6428 204 K 3.8151 8.8404 129.2509 57.8598 29.2222 174.5974 205 D 4.2660 7.9926 110.1919 55.2434 40.2297 172.2527 206 T 4.5324 7.4549 112.5614 61.2844 72.1694 172.5335 207 Y 4.6468 8.1911 123.2822 56.5595 39.9326 174.2975 208 F 5.2280 8.7876 123.8069 55.1778 41.6408 175.3967 209 V 3.9533 8.7726 124.9387 64.0761 31.4558 175.5087 210 T 4.6834 9.2370 117.6222 61.7871 71.5793 173.6956 211 G 4.7369 7.8999 107.3597 46.4801 0.0000 172.0181 212 I 5.1707 8.1616 120.5089 58.9664 40.9158 175.2396 213 V 3.5124 8.6193 126.8615 63.5354 31.6573 175.5558 214 S 4.8999 8.2523 124.2979 58.4852 62.4680 174.7256 215 W 4.6314 6.5159 113.6956 56.7617 31.1205 172.0209 216 G 4.1033 8.6893 104.5760 46.2911 0.0000 174.3608 217 E 4.5311 9.2502 121.6578 55.2047 28.7326 178.4971 218 G 3.6973 8.0964 112.6135 44.6441 0.0000 171.0385 218 C 4.2873 8.0864 122.4135 57.7441 24.8460 170.7385 221 A 3.7382 8.6518 125.5198 52.5789 16.7717 177.4336 222 R 3.9873 7.6422 117.5240 56.6322 30.5889 176.5889 223 K 4.3981 7.9638 121.5691 57.3646 32.5531 177.2780 223A G 4.0098 9.0186 111.0596 45.1667 0.0000 173.7665 224 K 4.3418 7.4230 117.2307 54.6168 34.8231 174.3308 225 Y 4.8992 8.0350 117.4534 56.3454 41.6087 174.9068 226 G 3.9522 8.4479 106.5340 45.3350 0.0000 173.0229 227 I 4.3124 7.6759 123.0465 59.1690 39.7406 174.5251 228 Y 4.8219 7.8541 123.1018 56.0300 42.2816 174.9649 229 T 4.4741 8.5543 118.3438 62.7194 69.8082 174.5762 230 K 4.6843 8.8108 127.3098 56.8272 32.0350 177.8071 231 V 4.0103 8.4868 124.8703 65.8303 30.9977 177.7432 232 T 3.8798 8.0662 109.2266 64.6663 68.3687 175.8102 233 A 3.9874 7.7489 121.5104 53.3907 18.4479 177.8171 234 F 5.0411 7.9812 115.2134 56.9027 40.4711 177.1205 235 L 4.0888 7.9939 123.5060 57.9692 41.3441 179.4218 236 K 4.0506 8.1222 119.1077 59.0418 32.1491 178.5943 237 W 4.1292 8.2880 128.3651 60.4056 30.7063 177.8203 238 I 3.5483 8.9395 120.2344 64.6590 36.4337 177.9590 239 D 4.1891 7.8438 118.0972 57.5670 40.8418 178.9893 240 R 3.9059 7.6460 117.7486 59.5162 29.8871 179.0961 241 S 3.7914 7.3466 113.8039 61.8630 62.8940 176.3896 242 M 2.8640 8.1329 119.1193 55.7188 32.4105 177.3474 243 K 4.5381 7.6635 120.2707 55.6349 31.9324 174.5761 244 T 4.5872 6.7453 108.2880 59.9136 71.9181 174.7789 245 R 3.9756 7.6346 116.6683 55.3987 29.8187 175.8360 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 16 I 7.88 4.23 1.86 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 1.55 0.45 0.99 0.00 0.00 17 V 9.05 4.34 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 1.06 0.00 0.00 1.01 0.00 0.00 18 G 8.73 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 19 G 9.18 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 20 Q 8.23 4.59 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.95 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 21 E 8.56 4.50 0.00 1.84 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 2.26 2.30 0.00 22 C 8.46 4.55 0.00 2.73 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 23 K 9.81 4.25 0.00 1.87 1.68 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.33 7.81 24 D 8.48 4.42 0.00 2.59 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 25 G 9.99 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 0.00 0.00 0.00 26 E 7.80 4.04 0.00 2.09 1.79 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 2.15 2.18 0.00 27 C 7.14 4.22 0.00 2.69 2.71 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 28 P 0.00 3.95 0.00 1.99 1.97 0.00 2.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.30 0.00 29 W 6.21 4.88 0.00 3.53 3.58 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 0.00 30 Q 7.58 4.80 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 31 A 8.37 4.89 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 32 L 8.42 4.59 0.00 1.58 1.44 0.74 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 33 L 9.09 5.15 0.00 0.38 0.89 0.08 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.34 5.04 1.84 0.00 0.00 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 1.62 0.80 0.92 0.00 0.00 35 N 9.17 5.30 0.00 2.89 2.97 0.00 0.00 6.55 7.67 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 36 E 8.84 3.98 0.00 2.10 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 2.28 2.28 0.00 37 E 8.88 4.41 0.00 2.02 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 2.43 2.57 0.00 38 N 8.02 4.17 0.00 2.86 2.88 0.00 0.00 6.85 7.25 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 39 E 7.99 4.37 0.00 2.38 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 40 G 8.67 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 0.00 0.00 0.00 41 F 8.95 5.04 0.00 2.94 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 42 C 7.30 4.69 0.00 1.71 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 43 G 8.77 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 0.00 0.00 0.00 44 G 8.00 4.50 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 0.00 0.00 0.00 45 T 8.97 5.21 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 1.27 0.00 0.00 46 I 8.85 4.15 2.02 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.09 1.19 0.00 0.00 47 L 8.74 4.41 0.00 1.95 1.82 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.57 4.86 0.00 4.15 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 49 E 8.97 3.94 0.00 1.55 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 50 F 8.75 4.22 0.00 3.04 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 51 Y 8.34 5.26 0.00 3.05 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.54 5.12 1.95 0.00 0.00 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 1.19 1.13 0.95 0.00 0.00 53 L 9.18 4.93 0.00 1.84 1.70 1.11 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.88 5.01 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 1.10 0.00 0.00 55 A 8.23 4.43 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 56 A 8.01 3.62 0.27 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 57 H 7.75 4.21 0.00 3.16 3.03 0.00 5.27 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 58 C 7.23 4.52 0.00 2.87 2.98 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 59 L 7.55 4.06 0.00 0.79 1.32 0.78 0.80 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 60 Y 7.52 5.03 0.00 3.11 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 61 Q 7.93 4.56 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.67 0.00 61A A 7.43 4.13 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.86 4.19 0.00 1.89 1.88 0.00 1.94 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.45 7.81 63 R 7.89 4.53 0.00 1.67 1.75 0.00 3.07 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 64 F 8.00 5.46 0.00 3.29 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 65 K 9.05 4.94 0.00 1.80 1.90 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.40 7.81 66 V 8.74 4.73 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 1.07 0.00 0.00 1.05 0.00 0.00 67 R 9.36 5.62 0.00 1.82 1.67 0.00 3.08 0.00 0.00 3.36 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 68 V 8.29 4.65 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 0.81 0.00 0.00 1.00 0.00 0.00 69 G 9.08 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 70 D 7.84 4.52 0.00 2.59 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 71 R 8.76 4.84 0.00 1.78 1.88 0.00 3.11 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 72 N 8.66 5.09 0.00 2.79 2.83 0.00 0.00 6.86 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 9.17 3.85 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 1.07 0.00 0.00 74 E 8.84 4.08 0.00 2.17 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 2.36 2.30 0.00 75 Q 7.40 4.46 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 7.56 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 76 E 8.50 4.37 0.00 1.95 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 2.31 2.27 0.00 77 E 7.98 3.98 0.00 1.93 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 2.34 2.58 0.00 78 G 8.42 3.78 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 0.00 0.00 0.00 79 G 8.76 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 0.00 0.00 0.00 80 E 7.44 5.01 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 81 A 8.39 4.53 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 82 V 8.33 4.78 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 0.86 0.00 0.00 0.91 0.00 0.00 83 H 9.22 5.03 0.00 3.08 3.15 0.00 5.66 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 E 8.61 4.59 0.00 1.93 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 2.36 2.30 0.00 85 V 8.32 4.02 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 0.81 0.00 0.00 1.10 0.00 0.00 86 E 9.09 4.25 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 87 V 7.59 4.59 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 0.74 0.00 0.00 0.95 0.00 0.00 88 V 8.44 4.72 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 0.92 0.00 0.00 0.99 0.00 0.00 89 I 9.35 4.45 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.14 0.90 0.00 0.00 90 K 8.46 4.71 0.00 1.80 1.81 0.00 2.19 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.42 7.81 91 H 8.44 4.30 0.00 2.71 3.20 0.00 5.66 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 9.13 4.57 0.00 2.93 3.06 0.00 0.00 6.17 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 93 R 7.79 4.20 0.00 0.67 0.66 0.00 3.03 0.00 0.00 2.99 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.10 0.00 94 F 8.45 4.70 0.00 3.04 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.42 4.17 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 1.17 0.00 0.00 96 K 8.00 3.36 0.00 1.73 1.60 0.00 1.39 0.00 0.00 1.46 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 1.33 7.81 97 E 8.06 4.01 0.00 1.84 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 98 T 7.73 4.08 4.29 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 1.22 0.00 0.00 99 Y 8.86 3.99 0.00 2.78 3.40 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 0.00 100 D 8.06 4.64 0.00 2.92 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 0.00 101 F 8.30 3.72 0.00 3.37 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 0.00 102 D 7.95 4.43 0.00 3.14 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.00 4.62 1.28 0.00 0.00 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 1.00 0.99 -0.34 0.00 0.00 104 A 9.27 4.96 1.20 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 0.00 0.00 105 V 8.87 4.99 2.18 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 1.24 0.00 0.00 1.16 0.00 0.00 106 L 9.02 5.13 0.00 1.72 1.67 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 R 9.10 4.11 0.00 1.61 1.63 0.00 2.96 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 108 L 9.01 4.55 0.00 1.59 1.60 0.83 1.01 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 0.00 109 K 9.17 4.34 0.00 1.92 1.86 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.40 7.81 110 T 7.73 4.71 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 1.23 0.00 0.00 111 P 0.00 3.51 0.00 1.51 1.18 0.00 3.53 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.66 0.00 112 I 8.44 3.52 1.65 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 1.06 0.16 0.99 0.00 0.00 113 T 8.22 4.13 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 1.18 0.00 0.00 114 F 7.95 4.70 0.00 3.04 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 0.00 115 R 8.85 4.41 0.00 1.91 2.05 0.00 2.81 0.00 0.00 3.43 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 116 M 8.58 4.03 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.62 0.00 117 N 9.48 4.38 0.00 2.94 2.99 0.00 0.00 6.50 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 0.00 118 V 8.24 4.60 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 1.16 0.00 0.00 0.99 0.00 0.00 119 A 8.43 4.47 1.08 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 0.00 120 P 0.00 5.06 0.00 2.04 1.98 0.00 3.26 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.37 0.00 121 A 8.07 4.45 0.66 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 0.00 122 C 8.10 4.34 0.00 2.42 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 0.00 123 L 8.43 4.91 0.00 1.69 1.67 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.64 0.00 2.23 1.98 0.00 3.87 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 2.03 2.06 0.00 124A E 8.48 4.38 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 125 R 8.75 3.72 0.00 1.88 1.89 0.00 3.16 0.00 0.00 3.31 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 126 D 8.02 4.34 0.00 2.73 2.71 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 0.00 127 W 8.16 3.78 0.00 3.24 3.22 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 0.00 128 A 8.23 3.42 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 0.00 129 E 7.62 3.64 0.00 1.85 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 130 S 7.02 4.28 0.00 3.77 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 0.00 131 T 7.01 3.85 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 0.14 0.00 0.00 131A L 7.03 4.22 0.00 1.39 1.41 0.19 0.83 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 131B M 7.47 3.28 0.00 1.53 1.93 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 132 T 7.03 3.97 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 0.98 0.00 0.00 133 Q 7.32 4.15 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.24 0.00 134 K 8.60 4.15 0.00 1.81 1.83 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.44 7.81 135 T 7.68 5.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 136 G 8.50 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 0.00 137 I 9.00 5.29 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.49 0.97 0.00 0.00 138 V 9.06 5.51 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 0.88 0.00 0.00 1.24 0.00 0.00 139 S 9.40 5.05 0.00 3.86 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 0.00 140 G 7.53 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 0.00 0.00 0.00 141 F 8.49 4.60 0.00 2.86 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 0.00 142 G 9.18 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 0.00 143 R 8.26 5.04 0.00 1.90 1.96 0.00 3.38 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 144 T 8.42 4.91 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 1.23 0.00 0.00 145 H 7.67 4.50 0.00 3.06 3.23 0.00 5.97 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.74 4.04 0.00 1.86 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 2.30 2.32 0.00 147 K 8.17 4.05 0.00 1.81 1.94 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.46 7.81 *149 G 7.60 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 0.00 0.00 0.00 150 R 8.16 4.85 0.00 1.90 2.08 0.00 2.99 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 151 Q 8.58 4.67 0.00 2.02 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.06 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 152 S 8.82 4.33 0.00 3.88 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 0.00 153 T 8.73 4.21 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 1.37 0.00 0.00 154 R 7.73 5.24 0.00 1.63 1.90 0.00 3.22 0.00 0.00 3.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 155 L 8.20 2.86 0.00 0.97 1.23 0.42 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.38 5.08 0.00 1.74 1.59 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.25 7.81 157 M 9.28 5.30 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.41 0.00 158 L 8.70 4.73 0.00 1.76 1.54 1.10 1.03 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 0.00 159 E 8.91 4.83 0.00 2.07 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 2.29 2.52 0.00 160 V 8.31 4.23 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 0.79 0.00 0.00 161 P 0.00 4.69 0.00 1.88 1.89 0.00 2.68 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.98 0.00 162 Y 8.58 4.40 0.00 2.78 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 0.00 163 V 7.94 4.44 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 0.25 0.00 0.00 0.15 0.00 0.00 164 D 8.47 4.49 0.00 2.83 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 0.00 165 R 8.86 3.84 0.00 1.90 2.01 0.00 3.21 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 166 N 8.27 4.34 0.00 3.01 2.88 0.00 0.00 7.02 7.57 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 0.00 167 S 8.32 4.16 0.00 3.98 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 0.00 168 C 8.58 4.46 0.00 2.95 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.83 3.97 0.00 2.06 1.89 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 170 L 8.32 4.12 0.00 1.63 1.97 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 171 S 7.81 4.54 0.00 4.37 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 0.00 172 S 7.18 4.71 0.00 4.14 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 0.00 173 S 8.85 4.47 0.00 3.34 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 F 7.69 4.95 0.00 3.12 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 0.00 175 I 8.50 3.81 1.95 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 1.51 0.83 1.01 0.00 0.00 176 I 8.23 4.46 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.13 0.99 0.00 0.00 177 T 8.19 4.35 4.29 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 1.40 0.00 0.00 178 Q 8.47 4.20 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.61 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 179 N 7.92 4.87 0.00 2.82 2.93 0.00 0.00 6.59 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.98 5.93 0.00 1.85 2.17 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.41 0.00 181 F 8.18 5.00 0.00 3.08 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 0.00 182 C 8.76 5.34 0.00 2.82 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 0.00 183 A 7.95 4.46 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.33 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 0.00 185 Y 8.12 4.97 0.00 3.13 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 185A D 8.81 3.99 0.00 2.86 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 185B T 7.54 4.45 4.24 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 1.21 0.00 0.00 186 K 8.03 3.92 0.00 1.58 1.35 0.00 1.51 0.00 0.00 0.74 0.00 0.00 2.75 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.86 1.21 7.81 187 Q 8.37 4.43 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.49 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 188 E 7.45 4.98 0.00 1.78 1.87 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 2.13 2.02 0.00 189 D 8.53 4.48 0.00 2.88 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 8.46 4.69 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 0.00 191 C 8.71 4.68 0.00 2.97 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 0.00 192 Q 8.45 4.27 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.48 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 193 G 9.14 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 0.00 0.00 0.00 0.00 194 D 8.53 4.60 0.00 2.89 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 0.00 195 S 7.97 4.41 0.00 3.96 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 0.00 196 G 9.72 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 0.00 0.00 0.00 197 G 7.96 4.37 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 0.00 198 P 0.00 4.96 0.00 2.35 2.29 0.00 3.68 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 199 H 8.99 4.96 0.00 2.99 3.28 0.00 5.52 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 9.17 4.93 2.08 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 1.10 0.00 0.00 0.53 0.00 0.00 201 T 8.68 4.98 4.35 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 1.39 0.00 0.00 202 R 8.74 4.66 0.00 1.16 1.74 0.00 2.94 0.00 0.00 2.90 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.15 0.00 203 F 8.93 4.65 0.00 3.21 3.33 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 0.00 204 K 8.84 3.82 0.00 1.72 1.68 0.00 1.97 0.00 0.00 1.56 0.00 0.00 2.61 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.95 0.21 7.81 205 D 7.99 4.27 0.00 2.71 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 0.00 206 T 7.45 4.53 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 0.56 0.00 0.00 207 Y 8.19 4.65 0.00 1.99 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 0.00 0.00 0.00 0.00 208 F 8.79 5.23 0.00 3.02 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 0.00 209 V 8.77 3.95 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 0.82 0.00 0.00 0.93 0.00 0.00 210 T 9.24 4.68 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 1.27 0.00 0.00 211 G 7.90 4.74 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 0.00 0.00 0.00 212 I 8.16 5.17 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.81 0.93 0.00 0.00 213 V 8.62 3.51 2.25 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 0.76 0.00 0.00 1.20 0.00 0.00 214 S 8.25 4.90 0.00 3.88 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 0.00 215 W 6.52 4.63 0.00 3.31 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 0.00 216 G 8.69 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 0.00 0.00 0.00 217 E 9.25 4.53 0.00 2.12 2.08 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 2.80 2.84 0.00 218 G 8.10 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 0.00 218 C 8.09 4.29 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 0.00 221 A 8.65 3.74 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 0.00 222 R 7.64 3.99 0.00 1.87 1.85 0.00 3.31 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 223 K 7.96 4.40 0.00 1.70 1.74 0.00 1.87 0.00 0.00 0.81 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 223A G 9.02 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 0.00 0.00 0.00 224 K 7.42 4.34 0.00 1.67 1.67 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.32 7.81 225 Y 8.03 4.90 0.00 2.79 2.85 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 0.00 0.00 0.00 226 G 8.45 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 0.00 0.00 0.00 227 I 7.68 4.31 0.56 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 -0.36 0.39 0.00 0.00 228 Y 7.85 4.82 0.00 1.43 2.47 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 0.00 229 T 8.55 4.47 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 1.11 0.00 0.00 230 K 8.81 4.68 0.00 1.88 1.92 0.00 1.67 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.66 1.91 7.81 231 V 8.49 4.01 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 1.27 0.00 0.00 1.12 0.00 0.00 232 T 8.07 3.88 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 1.15 0.00 0.00 233 A 7.75 3.99 0.77 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 0.00 234 F 7.98 5.04 0.00 3.20 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 7.99 4.09 0.00 1.78 1.79 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 236 K 8.12 4.05 0.00 1.85 1.90 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.48 7.81 237 W 8.29 4.13 0.00 3.68 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 0.00 238 I 8.94 3.55 2.22 0.00 0.00 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 1.88 1.45 0.95 0.00 0.00 239 D 7.84 4.19 0.00 2.64 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 0.00 240 R 7.65 3.91 0.00 1.85 1.69 0.00 3.07 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 241 S 7.35 3.79 0.00 3.38 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 0.00 242 M 8.13 2.86 0.00 1.39 1.91 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.15 0.00 243 K 7.66 4.54 0.00 1.72 1.71 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.49 7.81 244 T 6.75 4.59 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 1.18 0.00 0.00 245 R 7.63 3.98 0.00 1.91 1.88 0.00 3.01 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.