NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2381 7.8827 121.4528 61.2063 38.6375 173.8410 17 V 4.4387 8.7338 126.5884 61.3177 32.8045 174.2967 18 G 3.9671 8.7720 115.9708 45.4612 0.0000 171.9006 19 G 3.8606 9.2041 110.2347 45.8713 0.0000 171.7011 20 Q 4.6001 8.2758 117.0490 54.6191 32.7525 173.8525 21 E 4.4301 8.5782 120.4388 56.0730 30.3817 176.9915 22 C 4.4637 8.8532 124.1745 57.0231 39.2888 173.8342 23 K 4.3412 9.0903 122.3034 55.0984 32.9607 175.7081 24 D 4.2350 8.3454 119.6793 55.5715 41.1153 177.4475 25 G 3.8277 9.0324 114.6685 45.7856 0.0000 174.1485 26 E 3.8258 8.6338 120.1791 58.6425 30.1802 176.9610 27 C 4.2564 7.2451 114.1683 54.8008 34.9883 173.2148 28 P 3.9289 0.0000 0.0000 64.3423 31.8801 178.5903 29 W 5.2417 6.2279 113.7720 56.3976 28.6540 175.3050 30 Q 4.6667 7.4692 121.8983 56.3156 29.2224 174.9231 31 A 4.9869 9.2280 127.2939 50.0231 23.3558 174.5699 32 L 4.9327 8.4889 120.5913 53.1685 45.5857 175.6038 33 L 4.7174 8.5687 127.8215 54.3286 42.5455 175.8505 34 I 5.0387 8.7755 119.4331 59.0414 40.1274 176.3604 35 N 5.6865 9.5531 123.9475 51.5455 38.6257 175.1507 36 E 4.2044 8.7730 115.2091 58.9396 28.7758 177.1813 37 E 4.3914 9.1868 118.8673 55.7359 29.8678 176.2116 38 N 4.2282 8.5585 115.4341 54.1248 36.6493 173.4769 39 E 4.6720 7.7513 114.8434 54.1696 31.4717 176.2526 40 G 3.9377 8.4557 112.4254 45.8954 0.0000 173.2291 41 F 5.0430 7.9067 113.5486 56.3241 40.3587 173.2059 42 C 4.7506 7.2159 115.3528 56.6244 42.4485 172.6523 43 G 4.5245 8.7668 108.9778 45.2513 0.0000 171.7586 44 G 4.5710 8.2547 104.7414 45.8668 0.0000 172.5189 45 T 5.3083 8.7469 116.9080 61.3770 71.7644 174.1107 46 I 4.2297 9.2907 128.0645 61.7330 37.3861 176.8570 47 L 4.3594 9.2034 128.4313 56.0203 42.1638 176.3586 48 S 4.9195 7.6025 111.1436 57.8800 65.2222 176.4217 49 E 3.6926 8.7145 117.2726 58.6294 29.2203 178.0133 50 F 4.6630 8.0560 114.5796 57.0195 40.7006 174.0339 51 Y 5.4131 7.8683 118.1520 56.1389 41.7772 174.4754 52 I 5.0756 8.8328 123.6878 59.4994 40.7633 174.1848 53 L 4.9617 9.1286 128.9294 54.4480 44.2365 175.3208 54 T 4.7983 8.8331 118.8282 61.5882 71.6140 171.1007 55 A 4.9289 8.2994 122.9307 50.3169 20.4674 178.4556 56 A 3.6730 8.4504 125.3509 55.2897 18.6223 179.5395 57 H 4.4495 7.7395 111.0506 58.4126 28.7292 176.9523 58 C 4.4519 7.7665 117.9255 59.3869 40.2244 175.7708 59 L 3.7630 8.0160 119.4828 57.2853 41.1720 177.4296 60 Y 4.5971 7.7250 114.6871 57.8844 37.8358 175.8107 61 Q 4.6035 8.0449 117.0949 55.1034 29.4288 175.1696 61A A 4.2809 7.3093 119.0019 50.6894 22.0301 177.3533 62 K 4.1451 8.7917 122.6113 59.0790 32.4934 177.7021 63 R 4.7169 8.2058 116.4985 54.7662 34.2095 173.8582 64 F 5.4673 7.8039 114.1501 55.9928 41.2553 172.8979 65 K 4.8069 9.4437 117.9557 54.8090 37.0888 175.4214 66 V 4.7439 8.9546 121.9715 61.4913 33.4915 174.1998 67 R 5.0708 9.1316 129.3619 54.8527 32.1675 175.4065 68 V 4.6239 8.9096 119.2528 60.3969 35.3428 177.1267 69 G 3.9425 9.0018 108.5712 45.8206 0.0000 173.6102 70 D 4.5590 7.8995 119.4604 54.2352 42.1746 175.5992 71 R 4.7326 8.5567 123.1006 56.3685 33.8581 174.7104 72 N 5.2516 8.6091 117.5641 52.1586 40.9470 175.1440 73 T 4.1357 9.3951 118.5796 63.9062 69.2437 176.6179 74 E 4.0092 8.4067 122.6944 59.1780 29.6502 177.0273 75 Q 4.5240 7.3090 111.7664 54.3675 31.5399 173.6191 76 E 4.1392 8.7114 120.6515 56.8459 29.6837 176.1804 77 E 4.5041 9.5824 125.3125 55.5114 30.4072 176.2988 78 G 4.0236 8.0744 107.5225 46.0843 0.0000 173.4943 79 G 4.0725 8.8186 107.3088 45.3427 0.0000 174.3698 80 E 4.4333 7.6684 117.1654 56.2853 30.5078 175.8004 81 A 4.6641 8.6603 122.2566 50.7323 22.9782 175.2487 82 V 4.7228 8.4037 122.1457 61.6233 33.5683 174.6082 83 H 4.9688 9.5464 124.8096 53.9513 32.1180 173.0351 84 E 4.4982 8.7415 122.1242 56.0500 31.0779 175.6720 85 V 4.2995 8.0859 123.2346 62.5396 32.0672 175.1686 86 E 4.3342 9.3806 130.3391 58.3704 30.1792 176.8137 87 V 4.5532 7.5236 117.6063 59.8537 35.3063 173.8410 88 V 4.5294 8.4648 122.6582 61.5728 33.2909 175.4960 89 I 4.4647 8.9756 130.1353 59.4925 37.4906 174.3468 90 K 4.6783 8.3485 126.8670 55.3337 33.9252 175.4713 91 H 4.3900 8.6802 126.1262 55.8756 30.3900 175.9141 92 N 4.3603 9.0185 124.4618 56.6249 38.4891 175.8353 93 R 4.2407 7.7271 114.1974 55.7238 30.0663 176.0560 94 F 4.6303 7.9754 121.1297 58.7097 39.8653 174.5109 95 T 4.2113 8.0057 124.2593 61.3407 70.2085 175.5457 96 K 3.6877 8.0376 126.0253 58.5343 32.5894 178.0723 97 E 3.9335 7.9793 119.1890 58.4763 29.8283 177.0820 98 T 3.8657 7.5447 105.1915 61.2120 69.6308 174.2847 99 Y 3.8601 8.0435 118.8950 58.9834 36.0986 169.4587 100 D 4.5422 7.7524 119.1447 55.1971 41.8901 175.5938 101 F 3.9482 8.3262 119.6384 58.7427 36.9035 176.4715 102 D 4.7750 8.1876 117.5696 53.2284 39.7011 174.5623 103 I 4.8325 6.8313 120.8608 59.4532 42.3694 173.7785 104 A 5.3020 8.9236 128.1352 50.9429 23.1312 175.1596 105 V 4.9410 9.3881 120.7380 61.1067 34.9993 174.3152 106 L 5.2715 9.2860 126.9822 53.0349 44.6175 175.2540 107 R 4.4171 9.0279 125.3362 55.0808 31.4130 175.4306 108 L 4.8034 8.4594 126.8812 54.0480 42.4658 177.3503 109 K 4.2350 9.1590 122.2009 58.9589 32.6253 177.9525 110 T 4.8236 7.8101 114.8132 60.5936 71.7396 171.6113 111 P 3.7548 0.0000 0.0000 62.1790 31.8671 176.3215 112 I 3.7458 8.6718 125.7095 61.8399 37.9974 176.1786 113 T 4.1875 8.2065 122.2211 61.5401 69.1383 174.5023 114 F 4.7845 8.1025 126.0232 57.9866 39.9214 175.5168 115 R 4.4973 8.6477 121.0456 55.7091 31.6478 173.2186 116 M 4.1319 8.6187 117.5861 57.6507 32.4388 176.4763 117 N 4.0374 9.0634 121.0502 53.7452 36.4895 174.1177 118 V 4.5097 7.6606 118.9438 62.2066 32.9036 172.9979 119 A 4.3971 8.1953 127.4810 49.7899 22.8604 173.6478 120 P 5.0267 0.0000 0.0000 62.5364 32.8045 175.1819 121 A 4.2648 8.2579 122.5050 50.2680 20.7035 177.0564 122 C 4.2213 7.9116 118.7202 59.6718 29.6154 173.0143 123 L 4.8580 8.4353 122.7192 52.7150 42.3141 175.0739 124 P 4.8198 0.0000 0.0000 61.6887 32.9894 175.9042 124A E 4.2205 8.4530 118.5634 55.6734 30.9951 177.3388 125 R 3.8838 8.7709 124.3135 60.0670 30.0562 178.0552 126 D 4.3211 8.1386 117.6032 57.3758 40.8770 178.7627 127 W 3.9684 8.1542 127.9108 60.1301 30.6644 177.7541 128 A 3.5067 8.1231 120.8603 54.8922 17.5826 179.4226 129 E 3.8000 7.6576 116.0719 59.6312 29.6811 179.5578 130 S 4.0603 7.5958 112.7244 60.8064 63.2740 175.5098 131 T 3.9036 7.4911 116.9878 63.0400 69.9350 175.7403 131A L 3.9473 6.5283 119.8531 56.6810 42.3959 178.5060 131B M 3.1712 8.0854 118.2627 57.3184 31.9322 177.4013 132 T 3.9929 6.9970 107.1315 61.2290 69.3019 174.7252 133 Q 4.2249 7.4507 121.9827 55.3989 29.8565 176.3958 134 K 4.3284 8.6272 118.6591 59.5305 33.0886 176.9891 135 T 5.2378 7.8340 106.7806 60.2767 72.7393 172.0832 136 G 4.1009 8.7985 107.7443 44.9091 0.0000 171.2986 137 I 5.3087 8.8893 119.9775 59.2452 40.7292 175.6003 138 V 5.4549 9.1733 125.8944 59.1296 34.4935 174.6579 139 S 5.0569 9.1006 116.0770 56.4210 66.8545 173.0055 140 G 3.9952 7.3701 108.9667 46.0410 0.0000 172.6435 141 F 4.6146 8.3769 115.3436 57.2788 39.9902 177.5452 142 G 4.0117 8.7217 108.7873 46.1209 0.0000 172.9010 143 R 4.6724 9.0861 119.7267 56.8296 30.5350 178.3168 144 T 4.4393 9.0804 114.0276 63.1971 69.9006 174.1261 145 H 5.0023 8.0153 119.4786 54.0777 32.8386 173.8774 146 E 3.9434 8.9857 123.2094 59.2719 29.5770 178.5926 147 K 4.4937 8.0333 115.6159 56.0746 34.0710 175.9173 *149 G 4.3506 7.8048 106.2734 46.5126 0.0000 173.0256 150 R 4.5693 8.3657 118.2556 55.4990 32.0152 176.3191 151 Q 4.7534 8.4775 119.3190 55.7534 30.0211 175.6990 152 S 4.6641 8.6847 117.0242 58.0941 62.8453 174.3961 153 T 4.3925 8.7822 116.4444 62.6827 69.9361 174.0243 154 R 5.2614 7.5923 121.4431 54.0115 32.9465 175.6637 155 L 2.9128 8.3257 125.0889 54.7990 43.0073 176.0239 156 K 5.1024 8.4597 125.6135 54.7862 35.6848 174.9595 157 M 5.3490 9.3870 119.4960 53.8758 35.3239 174.0486 158 L 4.7863 8.9181 121.5627 53.8834 46.1363 173.9782 159 E 4.7272 8.9529 127.7712 55.7955 30.7415 175.6954 160 V 4.2919 8.7948 120.4721 58.4563 35.0263 173.6535 161 P 4.7215 0.0000 0.0000 62.8770 32.5757 175.2852 162 Y 4.3772 8.6254 119.8153 57.9958 38.6613 175.2054 163 V 4.2436 8.3396 123.2573 60.5503 33.7891 175.0415 164 D 4.3710 8.6630 126.7200 54.5066 41.9138 176.6476 165 R 3.8764 8.7542 125.2593 60.0046 30.0760 178.6405 166 N 4.2008 8.2745 115.4723 56.3046 38.6037 177.1861 167 S 4.1279 8.4517 114.5852 61.4095 62.2344 175.4261 168 C 4.2827 8.2400 120.3728 59.6446 42.6769 175.1328 169 K 4.0645 8.7211 120.8829 59.5899 31.5092 178.6023 170 L 3.9685 8.1968 119.4749 58.5408 42.0737 179.0260 171 S 4.3096 8.1145 111.1004 59.0838 63.5577 173.7999 172 S 4.8544 7.7818 118.6161 57.1465 63.1653 173.8717 173 S 4.3087 10.0359 122.2840 58.7773 63.5075 173.8681 174 F 5.1037 7.4189 119.0054 55.0403 41.7403 174.8271 175 I 3.7798 8.4307 122.8158 61.3067 38.1847 175.5256 176 I 4.4810 8.3368 128.8592 59.8325 37.6398 175.5202 177 T 4.3305 8.1707 116.0984 60.4734 69.8929 175.4386 178 Q 4.1342 8.4454 121.4155 57.7288 29.2381 175.8281 179 N 4.5926 8.1300 114.3354 54.0273 38.7259 173.7085 180 M 5.5910 7.8968 117.6939 54.0204 36.6362 173.9358 181 F 4.9760 8.5685 113.5397 56.5702 41.8896 172.2704 182 C 5.5378 8.9259 116.0737 55.5712 44.0926 172.8988 183 A 4.8100 9.0384 122.5751 51.5005 22.6701 175.6789 184 G 3.9799 7.6286 106.9135 44.3115 0.0000 172.6604 185 Y 4.8819 8.1662 116.9315 56.1538 40.6055 175.7958 185A D 4.2713 8.8818 120.4822 57.0478 41.6101 177.8493 185B T 4.4593 7.6208 105.9573 61.0537 70.8196 174.2285 186 K 3.7341 8.1776 123.2723 56.9221 32.8426 177.5284 187 Q 4.4482 8.3727 127.2439 55.4344 26.9579 175.6893 188 E 5.5140 7.3396 115.8490 54.0176 34.0760 176.0005 189 D 4.5255 8.3697 121.8313 54.0910 44.7370 174.7054 190 A 4.8378 8.6902 123.3019 51.5615 20.5345 176.4219 191 C 4.7613 9.8060 118.2706 55.1236 42.2982 172.8716 192 Q 4.2770 8.6272 119.4440 57.9122 28.5190 177.9536 193 G 4.2121 9.1488 109.7477 45.7557 0.0000 174.1246 194 D 4.6822 8.3473 118.3180 54.8496 41.8686 176.8719 195 S 4.5268 7.8993 115.7887 60.2756 63.5999 174.6675 196 G 3.5951 8.9547 112.2542 46.5787 0.0000 173.9299 197 G 4.3232 7.9832 107.1890 45.6027 0.0000 171.1068 198 P 5.2034 0.0000 0.0000 62.4430 33.5838 174.7191 199 H 5.3085 8.9067 120.8079 54.7913 32.7788 172.4687 200 V 5.0094 9.1665 118.9896 59.8715 35.7166 174.6959 201 T 4.8496 8.9299 120.1440 61.8597 71.1680 173.2373 202 R 4.4280 8.4632 126.2537 54.7850 31.9583 175.4153 203 F 4.5197 8.7825 127.4221 57.1017 41.7446 174.6488 204 K 3.8249 8.7484 129.5616 57.8651 29.1377 175.3527 205 D 4.5116 8.1465 111.4048 55.3841 38.8643 173.8967 206 T 4.7064 7.6258 115.6449 62.0383 71.7444 172.6141 207 Y 4.7435 8.7112 124.4663 56.9176 39.7191 174.4802 208 F 5.0616 9.0466 123.1025 55.2669 42.2344 175.2022 209 V 4.1462 8.7953 124.2782 63.4589 31.1828 175.7260 210 T 4.7400 9.3682 116.4155 61.5103 71.1174 173.2834 211 G 4.8995 7.9970 107.9227 46.6920 0.0000 171.8506 212 I 4.9791 8.2980 119.6262 58.9088 41.0106 175.0119 213 V 3.2598 8.7507 127.3263 64.1401 31.7991 175.3474 214 S 4.8319 8.2644 122.4395 58.7389 63.1946 174.3548 215 W 4.8034 6.9474 114.6384 57.4334 31.6094 172.4827 216 G 4.2918 8.7129 107.3970 46.4360 0.0000 173.7312 217 E 4.3426 9.2694 122.7307 56.5591 28.6056 177.9930 218 G 4.0205 8.1887 114.3263 44.6515 0.0000 171.1021 218 C 4.6105 8.1787 124.1263 57.7515 25.7292 170.8022 221 A 3.7130 9.0792 129.2929 53.1585 16.3847 177.3752 222 R 4.2876 7.6350 118.5900 55.9730 31.4713 176.9816 223 K 4.1785 8.4369 121.4677 57.9798 32.3401 177.6326 223A G 4.0420 9.2259 111.9851 45.3464 0.0000 173.1968 224 K 4.4141 7.6828 118.2394 54.4570 34.7873 174.5451 225 Y 4.9272 8.1143 118.0916 56.0783 42.2305 174.7089 226 G 3.9419 9.0259 107.5693 45.4974 0.0000 172.9875 227 I 4.5396 7.9547 125.7748 59.6061 38.9959 174.4328 228 Y 4.7970 7.9360 124.1050 55.9376 41.6623 175.1867 229 T 4.5242 8.8060 120.0835 63.3659 70.1634 174.3037 230 K 4.8433 9.4679 128.1357 55.6587 32.1569 177.3268 231 V 3.8904 8.4716 127.7943 66.3300 31.2921 177.6809 232 T 3.8393 8.0361 107.7668 64.3989 68.4714 175.2528 233 A 4.1446 7.7338 121.7041 52.9332 18.8289 177.5805 234 F 5.3017 8.4438 115.8407 56.7180 40.7577 177.1369 235 L 4.2014 8.2852 124.1203 57.8871 41.3511 179.1711 236 K 4.0459 8.1723 119.2087 59.1131 32.2760 178.4714 237 W 4.1610 8.4959 128.2906 60.7208 30.6986 177.8820 238 I 3.6528 8.7688 120.2220 64.0815 36.2762 177.8700 239 D 4.2183 7.7430 118.1568 57.5999 41.5182 178.3825 240 R 3.9457 7.9437 118.4393 59.2445 30.0245 179.2785 241 S 3.7862 7.6163 115.0129 61.3814 62.3953 175.7762 242 M 2.6215 7.2492 118.1097 55.1063 31.5599 176.8347 243 K 4.4122 7.2438 117.0036 56.2284 33.3036 176.3074 244 T 4.0388 7.6749 117.4475 63.7870 68.9080 175.0175 245 R 4.1445 8.6310 124.4810 56.7843 30.1724 176.0390 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 4.24 1.85 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 1.28 1.06 1.05 0.00 0.00 17 V 8.73 4.44 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 1.46 0.00 0.00 0.96 0.00 0.00 18 G 8.77 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.20 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.28 4.60 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.94 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 21 E 8.58 4.43 0.00 1.97 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 2.32 2.32 0.00 22 C 8.85 4.46 0.00 2.72 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 23 K 9.09 4.34 0.00 1.91 1.67 0.00 1.80 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.33 7.81 24 D 8.35 4.24 0.00 2.58 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 9.03 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.63 3.83 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 27 C 7.25 4.26 0.00 2.66 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 3.93 0.00 2.01 1.96 0.00 2.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.26 0.00 29 W 6.23 5.24 0.00 3.54 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.47 4.67 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 31 A 9.23 4.99 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 32 L 8.49 4.93 0.00 1.72 1.49 0.92 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.57 4.72 0.00 0.37 0.75 0.24 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.78 5.04 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.90 0.86 0.00 0.00 35 N 9.55 5.69 0.00 2.92 3.00 0.00 0.00 6.60 8.52 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 36 E 8.77 4.20 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 9.19 4.39 0.00 2.18 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 2.26 2.26 0.00 38 N 8.56 4.23 0.00 2.85 2.95 0.00 0.00 6.79 7.58 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 39 E 7.75 4.67 0.00 2.05 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 2.29 2.40 0.00 40 G 8.46 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.91 5.04 0.00 3.01 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 42 C 7.22 4.75 0.00 1.86 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 43 G 8.77 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.25 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.75 5.31 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 1.35 0.00 0.00 46 I 9.29 4.23 2.14 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 1.34 1.03 1.17 0.00 0.00 47 L 9.20 4.36 0.00 1.95 1.84 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.60 4.92 0.00 4.18 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 49 E 8.71 3.69 0.00 1.55 1.51 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 2.32 2.21 0.00 50 F 8.06 4.66 0.00 3.04 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 51 Y 7.87 5.41 0.00 3.02 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 52 I 8.83 5.08 1.99 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 1.21 1.02 1.04 0.00 0.00 53 L 9.13 4.96 0.00 1.85 1.63 1.11 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.83 4.80 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 1.18 0.00 0.00 55 A 8.30 4.93 1.17 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 56 A 8.45 3.67 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.74 4.45 0.00 2.99 3.05 0.00 5.27 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 58 C 7.77 4.45 0.00 3.05 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.02 3.76 0.00 1.22 1.41 0.83 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.72 4.60 0.00 2.96 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 8.04 4.60 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.70 0.00 61A A 7.31 4.28 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.79 4.15 0.00 1.80 1.87 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.83 1.39 7.81 63 R 8.21 4.72 0.00 1.83 1.68 0.00 3.10 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 64 F 7.80 5.47 0.00 3.41 3.29 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 65 K 9.44 4.81 0.00 1.75 1.89 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.40 7.81 66 V 8.95 4.74 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 0.98 0.00 0.00 1.13 0.00 0.00 67 R 9.13 5.07 0.00 1.87 1.72 0.00 2.99 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 68 V 8.91 4.62 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.06 0.00 0.00 69 G 9.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 D 7.90 4.56 0.00 2.60 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 71 R 8.56 4.73 0.00 1.79 1.92 0.00 3.31 0.00 0.00 3.06 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 72 N 8.61 5.25 0.00 2.79 2.81 0.00 0.00 6.80 8.34 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 73 T 9.40 4.14 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 0.78 0.00 0.00 74 E 8.41 4.01 0.00 2.29 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 75 Q 7.31 4.52 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 76 E 8.71 4.14 0.00 1.94 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 2.28 2.32 0.00 77 E 9.58 4.50 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 78 G 8.07 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 79 G 8.82 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.67 4.43 0.00 1.95 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 2.30 2.52 0.00 81 A 8.66 4.66 1.23 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 0.00 0.00 0.00 82 V 8.40 4.72 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 83 H 9.55 4.97 0.00 3.14 3.16 0.00 5.66 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.74 4.50 0.00 1.91 1.82 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 2.37 2.29 0.00 85 V 8.09 4.30 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 0.83 0.00 0.00 0.94 0.00 0.00 86 E 9.38 4.33 0.00 2.00 1.97 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 2.24 2.20 0.00 87 V 7.52 4.55 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.96 0.00 0.00 88 V 8.46 4.53 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 0.91 0.00 0.00 0.95 0.00 0.00 89 I 8.98 4.46 1.99 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 1.10 0.63 0.79 0.00 0.00 90 K 8.35 4.68 0.00 1.79 1.76 0.00 1.86 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.39 7.81 91 H 8.68 4.39 0.00 2.68 3.04 0.00 5.66 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 9.02 4.36 0.00 2.76 2.88 0.00 0.00 7.06 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 7.73 4.24 0.00 0.67 1.23 0.00 3.16 0.00 0.00 3.01 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.80 0.00 94 F 7.98 4.63 0.00 3.02 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 95 T 8.01 4.21 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 96 K 8.04 3.69 0.00 1.50 1.70 0.00 1.53 0.00 0.00 1.23 0.00 0.00 2.32 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.14 1.02 7.81 97 E 7.98 3.93 0.00 1.75 1.80 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 2.14 2.15 0.00 98 T 7.54 3.87 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 1.13 0.00 0.00 99 Y 8.04 3.86 0.00 2.74 3.28 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 0.00 100 D 7.75 4.54 0.00 2.77 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 0.00 101 F 8.33 3.95 0.00 3.31 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 0.00 102 D 8.19 4.78 0.00 3.18 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 6.83 4.83 1.51 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.20 -0.53 0.00 0.00 104 A 8.92 5.30 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 0.00 105 V 9.39 4.94 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 1.17 0.00 0.00 1.09 0.00 0.00 106 L 9.29 5.27 0.00 1.70 1.67 1.12 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 107 R 9.03 4.42 0.00 1.83 1.90 0.00 2.50 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.40 0.00 108 L 8.46 4.80 0.00 1.73 1.72 0.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 109 K 9.16 4.24 0.00 1.74 1.89 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.48 7.81 110 T 7.81 4.82 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 0.00 111 P 0.00 3.75 0.00 1.41 0.49 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 112 I 8.67 3.75 1.75 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 0.91 0.31 1.00 0.00 0.00 113 T 8.21 4.19 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 114 F 8.10 4.78 0.00 3.01 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 0.00 115 R 8.65 4.50 0.00 1.98 2.06 0.00 2.79 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 116 M 8.62 4.13 0.00 1.96 2.01 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 2.54 2.60 0.00 117 N 9.06 4.04 0.00 2.91 2.82 0.00 0.00 6.54 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 7.66 4.51 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 1.06 0.00 0.00 0.98 0.00 0.00 119 A 8.20 4.40 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 5.03 0.00 2.05 2.02 0.00 3.13 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 1.75 1.58 0.00 121 A 8.26 4.26 0.74 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 0.00 122 C 7.91 4.22 0.00 2.09 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.44 4.86 0.00 1.71 1.71 0.98 1.15 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 4.82 0.00 2.28 2.01 0.00 3.92 0.00 0.00 4.08 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 124A E 8.45 4.22 0.00 2.01 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 2.39 2.33 0.00 125 R 8.77 3.88 0.00 1.90 1.97 0.00 3.19 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 126 D 8.14 4.32 0.00 2.74 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 8.15 3.97 0.00 3.23 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 0.00 128 A 8.12 3.51 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 0.00 129 E 7.66 3.80 0.00 1.96 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 2.22 2.51 0.00 130 S 7.60 4.06 0.00 3.87 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 0.00 131 T 7.49 3.90 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 0.21 0.00 0.00 131A L 6.53 3.95 0.00 1.30 1.36 0.09 0.80 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 131B M 8.09 3.17 0.00 1.41 1.88 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 132 T 7.00 3.99 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 0.97 0.00 0.00 133 Q 7.45 4.22 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 134 K 8.63 4.33 0.00 1.73 1.87 0.00 1.60 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.43 7.81 135 T 7.83 5.24 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 1.22 0.00 0.00 136 G 8.80 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 0.00 137 I 8.89 5.31 2.12 0.00 0.00 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 1.41 0.81 1.01 0.00 0.00 138 V 9.17 5.45 2.22 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 1.35 0.00 0.00 1.18 0.00 0.00 139 S 9.10 5.06 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.37 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 0.00 141 F 8.38 4.61 0.00 2.85 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 0.00 142 G 8.72 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 0.00 143 R 9.09 4.67 0.00 1.78 2.15 0.00 3.17 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.79 0.00 144 T 9.08 4.44 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 145 H 8.02 5.00 0.00 3.39 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.99 3.94 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 147 K 8.03 4.49 0.00 1.78 1.72 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.52 7.81 *149 G 7.80 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 0.00 0.00 0.00 0.00 150 R 8.37 4.57 0.00 1.82 1.90 0.00 3.15 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 1.73 1.69 0.00 151 Q 8.48 4.75 0.00 2.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 152 S 8.68 4.66 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 T 8.78 4.39 4.44 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 1.25 0.00 0.00 154 R 7.59 5.26 0.00 1.62 2.03 0.00 3.38 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 155 L 8.33 2.91 0.00 1.16 1.27 0.18 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.46 5.10 0.00 1.63 1.60 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.27 7.81 157 M 9.39 5.35 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 158 L 8.92 4.79 0.00 1.71 1.55 1.13 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.95 4.73 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 2.30 2.50 0.00 160 V 8.79 4.29 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 0.73 0.00 0.00 0.78 0.00 0.00 161 P 0.00 4.72 0.00 2.00 2.10 0.00 2.68 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.71 0.00 162 Y 8.63 4.38 0.00 2.77 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 0.00 163 V 8.34 4.24 1.74 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 0.02 0.00 0.00 0.38 0.00 0.00 164 D 8.66 4.37 0.00 2.74 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 R 8.75 3.88 0.00 1.90 1.91 0.00 3.23 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 166 N 8.27 4.20 0.00 2.80 2.86 0.00 0.00 6.63 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 8.45 4.13 0.00 4.22 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 0.00 168 C 8.24 4.28 0.00 2.99 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.72 4.06 0.00 1.94 1.90 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.64 7.81 170 L 8.20 3.97 0.00 1.99 1.78 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 171 S 8.11 4.31 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 7.78 4.85 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 S 10.04 4.31 0.00 3.54 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 0.00 174 F 7.42 5.10 0.00 3.11 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 0.00 175 I 8.43 3.78 1.93 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 1.49 0.80 0.94 0.00 0.00 176 I 8.34 4.48 1.96 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.13 0.98 0.00 0.00 177 T 8.17 4.33 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 1.26 0.00 0.00 178 Q 8.45 4.13 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.19 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 179 N 8.13 4.59 0.00 2.79 2.78 0.00 0.00 6.67 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.90 5.59 0.00 1.86 2.05 0.00 0.00 0.00 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.62 0.00 181 F 8.57 4.98 0.00 3.08 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.93 5.54 0.00 2.80 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 0.00 183 A 9.04 4.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.63 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 0.00 0.00 0.00 185 Y 8.17 4.88 0.00 3.17 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 185A D 8.88 4.27 0.00 2.91 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 185B T 7.62 4.46 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 1.20 0.00 0.00 186 K 8.18 3.73 0.00 1.51 1.39 0.00 1.05 0.00 0.00 0.61 0.00 0.00 2.65 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.06 1.20 7.81 187 Q 8.37 4.45 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.47 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 188 E 7.34 5.51 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.98 0.00 189 D 8.37 4.53 0.00 2.85 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 8.69 4.84 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.81 4.76 0.00 2.90 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.63 4.28 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.40 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 193 G 9.15 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.35 4.68 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.90 4.53 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 0.00 196 G 8.95 3.60 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 0.00 0.00 0.00 197 G 7.98 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.20 0.00 2.30 2.33 0.00 3.90 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.19 0.00 199 H 8.91 5.31 0.00 3.29 3.41 0.00 5.52 0.00 0.00 0.00 0.00 6.59 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 5.01 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 0.54 0.00 0.00 1.25 0.00 0.00 201 T 8.93 4.85 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 1.31 0.00 0.00 202 R 8.46 4.43 0.00 0.73 1.54 0.00 3.09 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.75 0.00 203 F 8.78 4.52 0.00 3.18 3.29 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 0.00 204 K 8.75 3.82 0.00 1.70 1.73 0.00 1.93 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.94 0.30 7.81 205 D 8.15 4.51 0.00 2.86 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 0.00 206 T 7.63 4.71 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 0.84 0.00 0.00 207 Y 8.71 4.74 0.00 2.05 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 9.05 5.06 0.00 3.08 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 V 8.80 4.15 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 0.84 0.00 0.00 0.96 0.00 0.00 210 T 9.37 4.74 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 1.26 0.00 0.00 211 G 8.00 4.90 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 0.00 212 I 8.30 4.98 1.96 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 1.34 0.92 0.95 0.00 0.00 213 V 8.75 3.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.13 0.00 0.00 214 S 8.26 4.83 0.00 3.97 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 6.95 4.80 0.00 3.40 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 8.71 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 0.00 0.00 0.00 0.00 217 E 9.27 4.34 0.00 2.08 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 0.00 2.88 2.59 0.00 218 G 8.19 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 0.00 218 C 8.18 4.61 0.00 2.86 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 0.00 221 A 9.08 3.71 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 0.00 222 R 7.63 4.29 0.00 1.87 1.82 0.00 3.15 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 223 K 8.44 4.18 0.00 1.71 1.73 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.43 7.81 223A G 9.23 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 0.00 0.00 0.00 224 K 7.68 4.41 0.00 1.71 1.63 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.79 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.29 1.49 7.81 225 Y 8.11 4.93 0.00 2.81 2.79 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 0.00 226 G 9.03 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 7.95 4.54 0.56 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 -0.36 0.27 0.00 0.00 228 Y 7.94 4.80 0.00 1.43 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 0.00 229 T 8.81 4.52 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 230 K 9.47 4.84 0.00 2.04 1.77 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.50 7.81 231 V 8.47 3.89 2.28 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 1.16 0.00 0.00 1.14 0.00 0.00 232 T 8.04 3.84 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 7.73 4.14 0.76 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 0.00 234 F 8.44 5.30 0.00 3.16 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 0.00 235 L 8.29 4.20 0.00 1.78 1.81 1.03 0.72 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 8.17 4.05 0.00 1.90 1.93 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.50 7.81 237 W 8.50 4.16 0.00 3.72 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 0.00 238 I 8.77 3.65 2.19 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 1.84 1.17 0.97 0.00 0.00 239 D 7.74 4.22 0.00 2.89 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 0.00 240 R 7.94 3.95 0.00 1.65 1.82 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.94 0.00 241 S 7.62 3.79 0.00 3.33 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 0.00 242 M 7.25 2.62 0.00 1.44 1.74 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 2.38 1.76 0.00 243 K 7.24 4.41 0.00 1.66 1.76 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.44 7.81 244 T 7.67 4.04 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 1.20 0.00 0.00 245 R 8.63 4.14 0.00 1.93 2.05 0.00 3.20 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.