NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5403 8.3193 115.3096 58.2434 63.7212 172.5570 3 F 4.8507 7.9237 120.6415 55.2031 41.0988 167.3920 4 V 4.7219 9.5196 120.4137 61.1163 34.7698 175.4633 5 V 4.8885 8.7085 127.2155 61.2775 34.2117 174.2100 6 I 4.9627 8.6031 127.8747 59.6232 40.4399 174.5235 7 I 4.7686 8.9987 128.1377 57.9157 39.2826 173.1480 8 P 4.6350 0.0000 0.0000 62.4536 32.4689 175.5147 9 A 4.7542 9.3010 130.0307 50.9463 20.1463 176.5452 10 R 4.3204 8.4114 122.3067 56.8242 30.1143 173.5020 11 Y 3.9315 8.8925 126.4095 59.4341 39.2123 175.9454 12 A 4.1094 8.0553 120.8148 52.1376 19.1495 176.7592 13 S 5.1020 8.4164 117.2180 58.3318 64.8696 177.5499 14 T 3.8169 9.0381 127.9920 67.6900 68.1579 176.3645 15 R 4.2693 7.8106 115.5457 56.9607 29.8818 178.9120 16 L 4.5528 7.3294 118.0936 53.7813 42.9337 172.8232 17 P 4.2260 0.0000 0.0000 63.0819 32.3185 176.8391 18 G 2.9812 8.1358 107.3540 45.4523 0.0000 175.7042 19 K 3.7464 7.2974 119.7394 59.0088 32.6282 177.0249 20 P 4.1905 0.0000 0.0000 65.3365 30.9984 176.8788 21 L 4.2924 7.8000 115.9976 54.4438 42.1208 177.1719 22 V 3.5194 7.6003 120.1244 63.2818 31.8347 174.4127 23 D 4.6194 8.5367 126.3013 53.8575 42.0526 175.6654 24 I 4.3567 8.5120 126.9618 60.0481 38.8532 175.2167 25 N 4.5162 9.9888 126.2220 54.3925 36.0149 175.4366 26 G 4.1395 8.9066 105.8765 45.1466 0.0000 174.1239 27 K 4.7519 7.9442 117.1994 53.9947 36.6612 175.6695 28 P 5.4698 0.0000 0.0000 62.0372 31.0791 178.0943 *30 I 4.0178 8.4476 112.7825 60.9909 39.8094 177.9351 31 V 3.5786 8.0245 119.6218 66.3920 31.2633 177.5176 32 H 4.1520 8.2087 115.3877 59.0618 28.4782 177.7294 33 V 3.6202 7.7997 119.3843 65.8352 31.3940 177.5034 34 L 3.9521 8.2385 120.3698 58.1703 41.8019 178.7951 35 E 3.9266 8.4504 118.6688 59.5615 29.5973 179.1032 36 R 4.1589 8.2102 119.0293 58.8558 30.0180 178.7039 37 A 4.0800 8.0987 119.0065 55.5537 18.6854 179.6022 38 R 4.0017 8.4182 116.8096 59.4020 30.1454 179.1190 39 E 4.1009 8.4537 118.6684 58.9888 29.1669 179.3713 40 S 4.4045 7.7109 113.5022 59.7869 63.1275 175.3471 41 G 3.9384 8.0186 109.3044 44.5787 0.0000 173.4072 42 A 2.5800 7.1534 122.0537 52.2280 18.7068 178.0482 43 E 4.1471 7.9732 121.0926 58.4896 30.5819 177.5555 44 R 4.5992 7.5668 119.4365 54.6859 33.6728 173.7270 45 I 5.0299 8.5131 126.5088 59.5607 40.1657 174.8855 46 I 4.6920 8.7657 127.1495 59.5039 40.7467 174.5738 47 V 4.4477 8.8362 128.0304 61.8454 33.0083 174.4713 48 A 5.0278 9.1154 131.2942 51.2021 19.9572 175.7603 49 T 4.9453 8.4530 116.8911 60.7472 70.9950 173.1965 50 D 4.9359 8.8280 123.2646 52.9678 40.4085 175.5708 51 H 4.6992 8.0602 117.7844 54.0819 31.8810 174.8191 52 E 4.0048 8.6144 125.7396 59.0836 29.5261 178.7231 53 D 4.3766 7.9822 119.1885 56.2079 39.5902 178.5706 54 V 3.5855 7.8254 118.9868 65.7527 31.5834 177.4970 55 A 3.9993 7.8714 120.0679 55.4748 18.1793 179.8853 56 R 3.8545 8.2336 116.1634 59.1158 30.0811 179.0219 57 A 3.9938 8.2363 120.8223 55.3323 18.3691 179.9265 58 V 3.5524 8.0491 116.8701 66.2550 31.7486 178.1454 59 E 4.1520 8.6466 118.4190 59.1785 29.0136 179.1404 60 A 4.0995 8.1118 120.0437 54.0335 18.3552 178.4076 61 A 4.6665 7.2984 117.1869 51.5273 19.7494 177.0012 62 G 3.8152 7.7579 106.5129 47.8341 0.0000 174.5428 63 G 4.1093 8.1776 106.4340 44.5013 0.0000 173.9826 64 E 4.5397 8.6028 123.1800 55.4743 31.2693 175.4813 65 V 4.8517 8.2978 118.3447 59.8645 35.0162 175.1781 66 C 4.8497 8.6703 125.5396 58.6514 34.4797 170.7776 *68 T 4.3213 8.3769 106.4482 61.6657 69.2273 175.4120 *74 S 4.1128 8.4827 107.7957 58.1201 63.6817 172.4170 75 G 4.0203 7.4894 109.8688 48.1690 0.0000 175.5584 76 T 3.7741 7.7848 108.0729 64.0381 69.5419 176.4895 77 E 3.9854 7.8625 123.8646 59.8895 29.3818 180.2084 78 R 3.9561 8.0074 119.8813 61.4702 29.3778 180.1749 79 L 4.1759 7.7564 120.5853 57.8785 42.0187 178.9975 80 A 3.9996 8.0149 123.2891 55.6512 18.2419 179.8846 81 E 3.9035 8.0693 116.7657 61.3566 29.6597 181.4928 82 V 3.7374 7.5562 119.3682 65.8563 31.5670 178.2001 83 V 3.7763 8.1921 118.3561 66.3625 31.2179 177.4291 84 E 3.9083 8.7039 118.6703 59.4825 29.1193 179.4332 85 K 3.9194 8.3589 118.9939 59.3131 32.3099 178.4192 86 C 4.0034 8.0285 114.4438 58.5694 29.3727 173.0840 87 A 3.7365 7.7898 123.7583 53.0161 16.1565 177.1984 88 F 4.5905 7.6052 119.2450 57.0967 40.3595 176.7497 89 S 4.4741 8.5871 117.8854 57.9804 64.0625 174.8563 90 D 4.4759 8.9473 121.9465 57.9056 40.5658 178.3404 91 D 4.7022 8.0121 114.0062 54.0285 39.7034 175.9360 92 T 4.0431 7.9681 119.0156 63.8150 69.5785 173.6460 93 V 4.2378 8.4743 127.0429 62.3288 33.1008 174.4582 94 I 5.0263 8.6756 128.8095 59.4925 40.4408 174.7942 95 V 4.6492 8.8121 125.8468 61.0853 34.2006 173.8178 96 N 5.1060 9.1799 128.1160 52.9655 39.9676 173.6796 97 V 4.7058 8.2749 126.9704 60.8047 33.6583 174.9943 98 Q 4.2192 8.8267 127.1196 56.2061 29.7052 177.0875 99 G 3.9454 8.4764 111.0766 47.4975 0.0000 174.4591 100 D 4.9867 8.0558 118.5190 52.8479 40.5206 180.7264 101 E 4.9168 7.4914 118.7657 55.0178 29.3219 174.7757 102 P 4.4205 0.0000 0.0000 62.5567 31.6507 177.1907 *104 I 3.8053 7.7013 118.2221 60.9185 38.9114 173.0432 105 P 4.2321 0.0000 0.0000 62.6434 31.8862 176.7449 106 A 4.0404 8.9905 125.7967 55.7272 18.2076 179.3808 107 T 3.8464 7.9942 107.7765 65.0310 68.4899 176.1606 108 I 4.0392 7.9618 115.0120 63.0045 37.6192 178.3103 109 I 3.6921 7.6036 122.5204 64.1514 36.8750 178.1157 110 R 3.5965 7.8499 119.0730 59.3295 29.9550 177.7434 111 Q 3.8870 7.9153 119.3013 59.4270 28.9854 178.6378 112 V 3.4422 7.3907 118.5525 66.0081 31.4076 177.8154 113 A 3.6924 7.2986 120.1163 55.1601 17.9476 179.2851 114 D 4.1927 8.4464 117.7693 57.6384 40.6673 178.8478 115 N 4.1974 8.5319 116.3222 56.1035 38.7793 177.0221 116 L 4.0181 8.0080 121.4714 58.0387 42.0244 178.4439 117 A 4.0496 7.7969 120.1314 54.6810 18.2420 178.1520 118 Q 4.4881 7.2825 111.2241 55.6538 29.0278 175.2784 119 R 4.5996 8.2259 117.9101 54.9687 33.3470 176.6838 120 Q 4.3307 8.6284 124.5812 55.1260 27.6501 175.4420 121 V 4.4208 7.1291 117.3892 60.7359 34.2654 175.6861 122 G 2.7392 7.8151 111.3085 48.4401 0.0000 173.7066 *124 A 4.5851 7.9282 122.1189 52.2092 20.5082 175.9173 125 T 4.7483 9.1170 111.1944 60.3865 73.1246 172.2057 126 L 5.3863 8.2099 118.9041 53.4386 46.5071 175.3116 127 A 5.1558 8.8058 120.9216 50.9292 23.4291 175.1974 128 V 4.6598 8.8276 118.2296 60.2677 35.2789 173.1161 129 P 4.7116 0.0000 0.0000 63.0664 31.9949 175.6634 130 I 4.2457 8.1649 124.9862 60.5344 37.4329 175.4078 131 H 4.7715 8.9884 124.4960 56.2526 29.7503 175.5463 132 N 4.9733 7.8155 116.5808 51.3438 40.7693 175.4097 133 A 4.2414 8.4805 125.0174 54.9192 18.6551 180.6150 134 E 3.9731 8.0541 116.3127 61.3092 30.1258 183.8438 135 E 4.2831 10.0159 120.3075 59.1676 29.3376 179.2075 136 A 3.6723 7.3889 119.2036 54.5030 18.3518 178.6943 137 F 4.4349 7.7205 114.3498 55.3846 39.6583 175.1155 138 N 4.7437 7.7745 119.8653 51.5966 39.2118 174.1572 139 P 4.6572 0.0000 0.0000 64.9440 31.7402 177.6589 140 N 4.4154 8.6787 115.4085 55.4745 38.6610 175.3497 141 A 4.2308 7.8225 121.7995 51.4175 19.3399 176.4571 142 V 4.3941 8.3205 123.3745 61.5578 33.2168 175.0585 143 K 5.6568 9.0250 127.8408 55.0174 33.9664 176.2357 144 V 4.5863 8.1566 121.5287 59.8394 34.2825 174.6705 145 V 4.3407 8.2043 122.8079 61.1385 33.8467 174.2165 146 L 4.9938 8.3863 127.3627 52.9050 44.4197 176.1115 147 D 4.6487 9.0842 122.0802 52.1446 40.6902 177.0794 148 A 3.9980 8.5633 121.4509 54.9099 18.2006 178.1529 149 E 4.3897 8.8789 113.7884 56.1787 29.7562 177.0939 150 G 3.7445 8.3999 108.3324 45.2286 0.0000 173.2504 151 Y 4.6010 7.6802 117.6771 56.9775 38.8012 174.5105 152 A 4.3341 8.6456 126.9074 52.3493 18.2458 177.6594 153 L 4.2434 9.7558 124.8177 57.8903 42.6357 177.0493 154 Y 4.8615 7.3793 115.8414 56.9830 41.9458 172.7908 155 F 5.0527 7.8707 122.4807 56.0838 42.1667 174.3969 156 S 4.6748 8.8000 114.6940 58.1264 65.6711 175.8823 157 R 4.2400 9.8252 121.6534 57.0167 30.3948 177.1570 158 A 4.1500 7.9997 121.2982 51.7674 18.7790 177.6956 159 T 4.2897 8.3306 116.7006 62.6560 67.6805 174.3282 160 I 5.0496 8.0721 119.1646 57.9017 40.7864 173.8013 161 P 4.4720 0.0000 0.0000 62.1907 31.9295 175.7407 162 W 4.5061 8.7737 130.6980 57.4366 31.2051 175.9339 163 D 4.2960 7.4208 126.4634 52.3142 39.4625 176.3500 164 R 4.1826 8.2279 122.9252 59.2701 29.7000 178.4723 165 D 4.3578 7.8779 119.1732 56.7550 40.8892 178.5940 166 R 3.8710 7.7005 118.7904 59.4626 30.0417 178.2540 167 F 5.0736 7.7443 116.3765 59.0168 38.9532 177.2463 168 A 4.3621 7.8815 122.9550 55.4495 18.1830 179.9542 169 E 4.2473 7.6928 115.5681 59.0235 30.4047 179.9462 170 G 4.2322 7.3177 106.7117 45.3697 0.0000 173.4114 171 L 4.4832 8.6027 120.5683 55.0864 41.9524 177.6126 172 E 4.4812 8.0386 114.8635 56.0562 29.9213 179.5875 173 T 4.5630 7.3163 108.2271 61.0912 72.0388 176.7415 174 V 4.8464 8.3972 117.9070 58.9526 35.6292 175.6874 175 G 4.1559 8.6239 111.1201 45.8084 0.0000 174.5195 176 D 4.9302 8.7244 126.1708 54.3156 41.2258 176.1828 177 N 4.6447 7.9815 114.7082 52.6172 38.0089 174.3305 178 F 4.7931 7.7694 118.0008 56.5379 41.5968 174.6646 179 L 5.1899 8.3381 121.0393 53.0423 45.6372 175.2511 180 R 4.7915 9.4101 125.7070 55.5146 31.3165 174.9566 181 H 4.8032 9.6765 128.4663 56.1793 30.9563 174.1572 182 L 4.4941 8.5256 125.2662 52.2420 44.0340 178.1760 183 G 3.5268 8.4308 111.0512 45.6746 0.0000 172.5480 184 I 4.2065 7.1415 120.5522 59.0226 39.1802 174.3192 185 Y 4.8483 8.0848 124.5321 56.0011 41.6824 174.7910 186 G 4.2768 8.4550 109.1039 44.6509 0.0000 171.6571 187 Y 4.9845 8.3450 119.8475 56.2295 41.8394 174.2093 188 R 4.7897 8.5616 119.3449 55.4796 31.6548 177.6054 189 A 4.1173 9.0066 123.3255 55.3992 17.8643 180.4720 190 G 3.6806 8.3673 104.5037 48.0048 0.0000 175.6396 191 F 3.8052 8.1664 122.4429 60.9816 39.6780 176.7297 192 I 3.3809 7.7335 119.7431 64.4696 36.7947 178.2102 193 R 4.0997 7.8054 115.9238 58.2911 29.5253 178.4582 194 R 3.9748 6.7892 121.3562 60.4109 30.4574 182.8585 195 Y 2.5488 7.2192 121.1903 60.3575 38.3734 179.1129 196 V 3.8083 7.3952 110.7694 63.5070 31.6685 176.6283 197 N 4.7398 7.6193 113.9839 52.4776 39.2443 175.3936 198 W 4.3562 7.2522 119.0625 56.4582 29.5608 175.7068 199 Q 4.1384 8.3467 123.1622 54.9085 28.9114 174.0857 200 P 4.3000 0.0000 0.0000 63.4065 31.2530 175.8924 201 S 3.1646 9.3406 118.0309 56.6528 62.5882 173.2091 202 P 3.8367 0.0000 0.0000 65.5497 30.9467 178.6714 203 L 3.8502 6.9378 119.8821 57.8993 41.8185 178.2405 204 E 4.3329 7.0731 119.0836 59.4376 29.5653 178.3021 205 H 4.3756 7.9747 115.8997 58.9356 30.0933 176.9002 206 I 3.8313 7.1910 119.9983 64.6050 37.1839 176.8376 207 E 3.8163 8.3242 118.9729 58.0022 29.3526 177.1712 *209 L 4.0394 8.1754 122.1419 55.7326 43.5618 178.3845 210 E 4.3373 8.6529 123.2224 59.8148 30.0055 174.6947 211 Q 4.4225 7.9191 115.3474 59.2028 28.8259 177.9787 212 L 4.1951 7.9174 120.8951 57.4720 41.6157 178.9506 213 R 4.1374 8.0813 118.8521 59.3859 29.9858 178.6821 214 V 4.1996 8.3385 118.1139 66.2661 31.6760 178.0570 215 L 4.3349 8.2092 118.3011 57.7296 41.3869 179.1087 216 W 4.1880 8.6671 127.6403 60.3977 30.6655 176.6509 217 Y 3.8856 7.6880 113.5439 57.5343 37.3028 176.2271 218 G 3.8575 8.0187 108.2297 45.4642 0.0000 173.3918 219 E 4.7675 8.1424 118.7482 55.0367 31.3754 175.4221 220 K 4.7925 8.5459 119.3763 55.0451 35.5171 175.9411 221 I 4.8094 8.3507 122.5272 59.7778 40.3363 174.2975 222 H 4.5877 8.9953 127.8999 55.9039 31.2039 174.0351 223 V 4.8566 8.0883 124.4769 61.0865 34.1600 174.3295 224 A 4.7395 8.5654 128.0619 49.6132 23.1385 175.0520 225 V 4.0553 8.2695 119.3508 62.3970 31.9685 175.8429 226 A 4.1939 9.3041 131.0746 52.5236 18.8423 178.2357 227 Q 3.9561 9.0497 121.7899 58.0185 29.6148 175.7249 228 E 4.5863 7.3214 117.3476 54.8589 32.8661 174.3106 229 V 3.8586 8.2671 125.9444 61.3407 31.9318 173.8534 230 P 4.4120 0.0000 0.0000 62.1695 32.0208 176.5532 231 G 3.7407 8.4062 111.0273 45.3511 0.0000 173.4842 232 T 4.0510 8.2128 112.0163 60.5687 69.6178 174.6539 233 G 3.7815 8.3666 111.6327 45.7522 0.0000 172.7128 234 V 4.2936 8.0526 118.3082 61.0972 32.5252 174.6873 235 D 4.7433 8.6923 124.5866 51.8195 41.1899 175.9118 236 T 4.5132 7.5347 113.8145 59.7765 70.2043 173.3058 237 P 4.3195 0.0000 0.0000 66.1951 31.1664 178.6845 238 E 4.0130 8.0938 117.8866 59.2635 29.4905 178.7383 239 D 4.3686 7.9090 118.6240 57.0325 40.8446 178.3848 240 L 3.9362 8.3126 121.3420 58.2779 42.0717 178.9378 241 E 3.9445 8.0436 118.1437 59.3512 29.2669 178.8904 242 R 3.8419 8.0032 118.7301 59.6717 29.8727 178.4145 243 V 3.5387 7.7072 117.0815 66.2438 31.5950 177.7788 244 R 4.0401 8.0822 116.5368 59.4925 30.0089 178.5854 245 A 4.1395 8.0003 119.4708 54.9858 18.5031 177.7646 246 E 4.2077 8.2612 120.7163 56.7808 29.6805 176.8373 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 2 S 8.32 4.54 0.00 3.90 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 3 F 7.92 4.85 0.00 3.32 3.02 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 4 V 9.52 4.72 1.68 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 0.87 0.00 0.00 0.76 0.00 0.00 5 V 8.71 4.89 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 1.05 0.00 0.00 1.11 0.00 0.00 6 I 8.60 4.96 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.22 1.00 0.00 0.00 7 I 9.00 4.77 1.91 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 1.28 1.71 0.98 0.00 0.00 8 P 0.00 4.63 0.00 2.11 2.02 0.00 3.77 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 2.16 2.21 0.00 9 A 9.30 4.75 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 10 R 8.41 4.32 0.00 1.61 1.75 0.00 3.27 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.19 0.00 11 Y 8.89 3.93 0.00 2.74 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 12 A 8.06 4.11 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.42 5.10 0.00 3.85 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 14 T 9.04 3.82 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 15 R 7.81 4.27 0.00 1.83 1.82 0.00 3.26 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.00 16 L 7.33 4.55 0.00 1.72 1.50 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.23 0.00 2.13 2.00 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 18 G 8.14 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 0.00 0.00 0.00 19 K 7.30 3.75 0.00 1.99 2.17 0.00 1.31 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.45 7.81 20 P 0.00 4.19 0.00 2.24 2.27 0.00 3.48 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 21 L 7.80 4.29 0.00 1.77 1.77 1.07 0.82 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 22 V 7.60 3.52 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 0.90 0.00 0.00 0.90 0.00 0.00 23 D 8.54 4.62 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 8.51 4.36 2.00 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 1.30 0.94 0.89 0.00 0.00 25 N 9.99 4.52 0.00 2.88 2.88 0.00 0.00 7.43 7.65 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 26 G 8.91 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 0.00 0.00 0.00 0.00 27 K 7.94 4.75 0.00 1.82 1.80 0.00 1.21 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.23 1.04 7.81 28 P 0.00 5.47 0.00 2.25 2.09 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.91 0.00 *30 I 8.45 4.02 1.90 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 1.33 1.49 0.93 0.00 0.00 31 V 8.02 3.58 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 32 H 8.21 4.15 0.00 3.21 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.80 3.62 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.01 0.00 0.00 34 L 8.24 3.95 0.00 1.80 1.86 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.45 3.93 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 36 R 8.21 4.16 0.00 2.03 2.03 0.00 3.32 0.00 0.00 3.44 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 37 A 8.10 4.08 1.38 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 0.00 0.00 0.00 38 R 8.42 4.00 0.00 1.90 1.98 0.00 3.12 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 39 E 8.45 4.10 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 40 S 7.71 4.40 0.00 4.26 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 41 G 8.02 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 42 A 7.15 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.97 4.15 0.00 1.86 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 2.27 2.15 0.00 44 R 7.57 4.60 0.00 1.83 1.75 0.00 3.20 0.00 0.00 3.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 45 I 8.51 5.03 1.87 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 1.31 0.75 0.93 0.00 0.00 46 I 8.77 4.69 2.00 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 1.19 1.07 0.96 0.00 0.00 47 V 8.84 4.45 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 0.96 0.00 0.00 0.96 0.00 0.00 48 A 9.12 5.03 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 49 T 8.45 4.95 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 1.24 0.00 0.00 50 D 8.83 4.94 0.00 2.77 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 51 H 8.06 4.70 0.00 3.13 3.34 0.00 5.81 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.61 4.00 0.00 1.99 1.91 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 2.36 2.35 0.00 53 D 7.98 4.38 0.00 2.96 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 54 V 7.83 3.59 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 1.18 0.00 0.00 1.10 0.00 0.00 55 A 7.87 4.00 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 56 R 8.23 3.85 0.00 2.02 2.00 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 57 A 8.24 3.99 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 58 V 8.05 3.55 2.10 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 1.17 0.00 0.00 0.95 0.00 0.00 59 E 8.65 4.15 0.00 2.04 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 2.33 2.49 0.00 60 A 8.11 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.30 4.67 1.32 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 62 G 7.76 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.18 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 64 E 8.60 4.54 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 65 V 8.30 4.85 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.99 0.00 0.00 66 C 8.67 4.85 0.00 2.98 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 *68 T 8.38 4.32 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 1.28 0.00 0.00 *74 S 8.48 4.11 0.00 4.05 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 75 G 7.49 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 76 T 7.78 3.77 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 77 E 7.86 3.99 0.00 2.08 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 0.00 2.34 2.37 0.00 78 R 8.01 3.96 0.00 1.81 1.95 0.00 3.26 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.26 0.00 79 L 7.76 4.18 0.00 1.72 1.87 1.01 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.01 4.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.07 3.90 0.00 2.02 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 2.25 2.20 0.00 82 V 7.56 3.74 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 1.09 0.00 0.00 1.01 0.00 0.00 83 V 8.19 3.78 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 1.09 0.00 0.00 1.10 0.00 0.00 84 E 8.70 3.91 0.00 2.16 1.91 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 2.30 2.47 0.00 85 K 8.36 3.92 0.00 1.62 1.81 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.55 7.81 86 C 8.03 4.00 0.00 1.92 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 0.00 0.00 0.00 87 A 7.79 3.74 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 88 F 7.61 4.59 0.00 3.04 2.88 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 89 S 8.59 4.47 0.00 4.05 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.95 4.48 0.00 2.76 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 91 D 8.01 4.70 0.00 2.81 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 92 T 7.97 4.04 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 0.91 0.00 0.00 93 V 8.47 4.24 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 0.96 0.00 0.00 0.95 0.00 0.00 94 I 8.68 5.03 2.19 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.15 1.01 0.00 0.00 95 V 8.81 4.65 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 0.95 0.00 0.00 0.86 0.00 0.00 96 N 9.18 5.11 0.00 3.04 2.84 0.00 0.00 6.19 8.23 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 97 V 8.27 4.71 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 0.94 0.00 0.00 0.97 0.00 0.00 98 Q 8.83 4.22 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.35 0.00 99 G 8.48 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 0.00 100 D 8.06 4.99 0.00 2.61 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 0.00 101 E 7.49 4.92 0.00 2.08 1.88 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 2.22 2.20 0.00 102 P 0.00 4.42 0.00 2.09 2.15 0.00 3.83 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 *104 I 7.70 3.81 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 0.94 0.00 0.00 105 P 0.00 4.23 0.00 2.20 2.10 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 106 A 8.99 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.99 3.85 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 108 I 7.96 4.04 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.87 0.99 0.00 0.00 109 I 7.60 3.69 2.08 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 1.42 1.17 1.03 0.00 0.00 110 R 7.85 3.60 0.00 1.84 2.00 0.00 3.66 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.65 0.00 111 Q 7.92 3.89 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 112 V 7.39 3.44 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 0.84 0.00 0.00 0.87 0.00 0.00 113 A 7.30 3.69 0.32 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 0.00 114 D 8.45 4.19 0.00 2.70 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.53 4.20 0.00 2.77 2.82 0.00 0.00 7.04 7.63 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 0.00 116 L 8.01 4.02 0.00 1.74 1.78 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.80 4.05 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 0.00 118 Q 7.28 4.49 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.53 0.00 0.00 0.00 0.00 0.00 2.42 2.26 0.00 119 R 8.23 4.60 0.00 1.74 1.93 0.00 2.96 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 120 Q 8.63 4.33 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 121 V 7.13 4.42 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 0.97 0.00 0.00 1.18 0.00 0.00 122 G 7.82 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 0.00 0.00 0.00 *124 A 7.93 4.59 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 0.00 125 T 9.12 4.75 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 0.89 0.00 0.00 126 L 8.21 5.39 0.00 1.47 1.56 0.90 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.81 5.16 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 0.00 128 V 8.83 4.66 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 0.94 0.00 0.00 0.90 0.00 0.00 129 P 0.00 4.71 0.00 1.78 1.93 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 130 I 8.16 4.25 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.63 0.88 0.00 0.00 131 H 8.99 4.77 0.00 3.16 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 N 7.82 4.97 0.00 2.98 2.93 0.00 0.00 6.18 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 8.48 4.24 1.40 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 0.00 134 E 8.05 3.97 0.00 2.08 1.88 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 2.23 1.97 0.00 135 E 10.02 4.28 0.00 2.27 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 2.32 2.32 0.00 136 A 7.39 3.67 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 0.00 137 F 7.72 4.43 0.00 3.11 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 0.00 138 N 7.77 4.74 0.00 2.99 2.84 0.00 0.00 7.18 7.81 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 0.00 139 P 0.00 4.66 0.00 2.10 2.13 0.00 3.81 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 140 N 8.68 4.42 0.00 2.89 2.89 0.00 0.00 6.96 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 A 7.82 4.23 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.32 4.39 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 1.16 0.00 0.00 1.00 0.00 0.00 143 K 9.02 5.66 0.00 1.90 1.93 0.00 1.57 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.34 7.81 144 V 8.16 4.59 1.57 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 0.58 0.00 0.00 0.15 0.00 0.00 145 V 8.20 4.34 2.10 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 0.95 0.00 0.00 0.98 0.00 0.00 146 L 8.39 4.99 0.00 1.45 1.48 0.75 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 147 D 9.08 4.65 0.00 2.91 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 0.00 148 A 8.56 4.00 1.32 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 0.00 149 E 8.88 4.39 0.00 2.33 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 150 G 8.40 3.74 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 0.00 151 Y 7.68 4.60 0.00 3.51 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 0.00 152 A 8.65 4.33 1.01 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 0.00 153 L 9.76 4.24 0.00 1.58 1.82 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.38 4.86 0.00 2.96 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 0.00 155 F 7.87 5.05 0.00 2.63 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 0.00 156 S 8.80 4.67 0.00 3.95 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 9.83 4.24 0.00 1.91 2.06 0.00 3.24 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 158 A 8.00 4.15 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 0.00 159 T 8.33 4.29 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 0.57 0.00 0.00 160 I 8.07 5.05 2.01 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 1.61 0.76 1.10 0.00 0.00 161 P 0.00 4.47 0.00 2.12 2.04 0.00 3.20 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 162 W 8.77 4.51 0.00 3.56 3.17 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 0.00 163 D 7.42 4.30 0.00 2.11 1.54 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 0.00 164 R 8.23 4.18 0.00 2.57 2.54 0.00 3.16 0.00 0.00 3.45 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 165 D 7.88 4.36 0.00 2.65 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 0.00 166 R 7.70 3.87 0.00 1.72 1.51 0.00 3.29 0.00 0.00 3.51 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 167 F 7.74 5.07 0.00 2.69 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 0.00 168 A 7.88 4.36 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 E 7.69 4.25 0.00 2.21 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 2.26 2.19 0.00 170 G 7.32 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 0.00 0.00 0.00 0.00 171 L 8.60 4.48 0.00 1.11 0.47 0.96 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.04 4.48 0.00 1.97 1.81 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 2.15 1.85 0.00 173 T 7.32 4.56 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 0.00 174 V 8.40 4.85 2.34 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 0.80 0.00 0.00 1.01 0.00 0.00 175 G 8.62 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 D 8.72 4.93 0.00 2.66 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 0.00 177 N 7.98 4.64 0.00 2.54 2.72 0.00 0.00 6.15 7.43 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 0.00 178 F 7.77 4.79 0.00 3.10 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 0.00 179 L 8.34 5.19 0.00 1.68 1.49 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 180 R 9.41 4.79 0.00 1.86 1.90 0.00 3.09 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 181 H 9.68 4.80 0.00 3.24 3.46 0.00 5.97 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.53 4.49 0.00 1.57 1.40 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 183 G 8.43 3.53 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 0.00 0.00 0.00 184 I 7.14 4.21 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.04 0.76 0.00 0.00 185 Y 8.08 4.85 0.00 2.66 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 0.00 0.00 0.00 186 G 8.45 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 0.00 0.00 0.00 0.00 187 Y 8.34 4.98 0.00 3.00 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 0.00 188 R 8.56 4.79 0.00 1.98 2.19 0.00 3.19 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 189 A 9.01 4.12 1.45 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 0.00 0.00 190 G 8.37 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 F 8.17 3.81 0.00 3.16 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 0.00 192 I 7.73 3.38 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.05 0.71 0.00 0.00 193 R 7.81 4.10 0.00 1.90 1.98 0.00 3.02 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 194 R 6.79 3.97 0.00 1.65 1.95 0.00 3.30 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 195 Y 7.22 2.55 0.00 2.04 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.40 3.81 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 0.84 0.00 0.00 0.89 0.00 0.00 197 N 7.62 4.74 0.00 2.57 2.80 0.00 0.00 7.00 7.48 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 0.00 198 W 7.25 4.36 0.00 3.15 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 0.00 199 Q 8.35 4.14 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 200 P 0.00 4.30 0.00 2.15 2.21 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 201 S 9.34 3.16 0.00 3.30 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 0.00 202 P 0.00 3.84 0.00 2.10 2.07 0.00 2.20 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.74 0.00 203 L 6.94 3.85 0.00 1.58 1.65 0.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 204 E 7.07 4.33 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.25 0.00 205 H 7.97 4.38 0.00 3.12 3.23 0.00 5.79 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 I 7.19 3.83 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.85 0.92 0.00 0.00 207 E 8.32 3.82 0.00 2.00 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 2.44 2.55 0.00 *209 L 8.18 4.04 0.00 1.70 1.76 0.92 0.95 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 0.00 210 E 8.65 4.34 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.93 0.00 211 Q 7.92 4.42 0.00 1.96 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.87 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.00 212 L 7.92 4.20 0.00 1.91 1.86 0.89 0.89 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 0.00 213 R 8.08 4.14 0.00 2.21 2.20 0.00 2.21 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 214 V 8.34 4.20 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 1.31 0.00 0.00 1.75 0.00 0.00 215 L 8.21 4.33 0.00 2.00 1.94 1.37 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 216 W 8.67 4.19 0.00 3.32 3.16 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 0.00 217 Y 7.69 3.89 0.00 2.41 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 0.00 0.00 0.00 0.00 218 G 8.02 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 0.00 219 E 8.14 4.77 0.00 2.48 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 2.60 3.15 0.00 220 K 8.55 4.79 0.00 1.69 1.72 0.00 1.08 0.00 0.00 0.91 0.00 0.00 2.60 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.36 7.81 221 I 8.35 4.81 2.25 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.97 1.18 0.00 0.00 222 H 9.00 4.59 0.00 3.29 3.17 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 8.09 4.86 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 0.74 0.00 0.00 0.93 0.00 0.00 224 A 8.57 4.74 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 0.00 225 V 8.27 4.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.89 0.00 0.00 226 A 9.30 4.19 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 0.00 227 Q 9.05 3.96 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.61 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 228 E 7.32 4.59 0.00 1.96 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 229 V 8.27 3.86 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 0.86 0.00 0.00 0.92 0.00 0.00 230 P 0.00 4.41 0.00 2.17 2.01 0.00 3.53 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 1.94 2.03 0.00 231 G 8.41 3.74 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 0.00 232 T 8.21 4.05 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 0.00 233 G 8.37 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 0.00 234 V 8.05 4.29 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 0.87 0.00 0.00 0.96 0.00 0.00 235 D 8.69 4.74 0.00 2.75 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 0.00 236 T 7.53 4.51 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 1.33 0.00 0.00 237 P 0.00 4.32 0.00 2.29 2.29 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 238 E 8.09 4.01 0.00 2.03 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 2.39 2.39 0.00 239 D 7.91 4.37 0.00 2.94 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 L 8.31 3.94 0.00 1.70 1.83 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 241 E 8.04 3.94 0.00 2.05 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 2.32 2.45 0.00 242 R 8.00 3.84 0.00 2.01 2.14 0.00 3.10 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 243 V 7.71 3.54 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 0.85 0.00 0.00 0.95 0.00 0.00 244 R 8.08 4.04 0.00 1.97 1.99 0.00 3.38 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 245 A 8.00 4.14 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 E 8.26 4.21 0.00 2.18 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 2.34 2.19 0.00 * Residues marked with a * may have inaccurate shift predictions.