NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 V 4.0656 7.9133 120.3897 62.8453 33.9352 177.6918 8 K 3.8571 8.0822 119.2815 59.2662 32.0229 175.2963 9 E 4.3342 8.9840 120.4521 59.5085 29.5812 179.1914 10 L 4.0049 7.8318 117.9436 58.4576 42.1336 178.8910 11 L 4.0895 7.6135 118.0803 57.5169 41.3403 178.7243 12 E 3.8801 8.7800 117.4842 59.9538 29.4906 179.2835 13 A 3.5782 8.1708 122.6305 55.5173 18.5148 179.2782 14 G 3.8927 7.3868 102.6811 46.9529 0.0000 174.9579 15 V 4.6539 7.2568 110.8868 59.6027 33.6927 174.4243 16 H 4.8486 8.6022 111.1812 56.4335 31.8523 173.6799 17 F 4.9299 8.5810 115.1802 55.5252 40.7418 174.2512 18 G 3.4496 8.6452 103.3209 47.1455 0.0000 171.0523 19 H 4.8088 7.8269 128.7620 56.7529 32.4044 173.8780 20 E 3.6776 7.5732 114.1525 50.7567 30.7551 175.4434 21 R 4.8966 8.2605 119.6315 55.2472 31.9222 176.5534 22 K 3.8076 9.2313 120.9376 57.1213 30.6221 175.5311 23 R 4.6556 7.9517 118.4964 55.8117 30.6052 178.0658 24 W 4.4435 8.2248 116.0094 56.5325 28.7710 175.1127 25 N 3.5487 7.8950 112.0254 52.1961 40.4654 173.8644 26 P 2.9700 0.0000 0.0000 65.1540 31.0818 177.7977 27 K 3.9006 7.9464 117.4860 58.4063 32.1354 176.6668 28 F 4.6425 7.7579 121.3559 57.9647 39.7622 176.7735 29 A 4.4262 7.8463 124.4007 54.6079 19.3088 180.4892 30 R 3.8594 7.6399 110.1897 58.5143 29.7861 176.2768 31 Y 4.9196 6.7322 116.3938 55.4399 37.3202 175.0858 32 I 4.4257 7.1589 116.6936 60.5909 41.6152 172.8026 33 Y 4.3066 9.1542 129.0209 58.4640 39.5281 174.9484 34 A 4.1728 7.0297 118.8500 52.2996 22.8040 174.0790 35 E 5.1780 7.9607 116.2661 53.7671 29.8932 174.4940 36 R 4.0582 8.2293 125.6474 56.0246 30.9784 175.7139 37 N 4.2921 10.0988 121.5245 54.4287 37.7763 173.2246 38 G 4.1516 8.3318 106.9483 47.0569 0.0000 175.4606 39 I 3.8348 7.9541 120.3978 61.2243 37.4091 174.6324 40 H 4.7657 8.4482 120.4910 55.5555 29.9937 174.6003 41 I 4.2954 9.2296 126.4903 59.2083 38.0646 175.2436 42 I 4.1920 8.3719 127.3887 60.9597 38.9332 174.8425 43 D 4.7026 8.7327 127.0130 53.8168 41.5904 176.7680 44 L 4.2112 8.6808 127.5520 57.8319 41.5559 178.7363 45 Q 3.9200 8.3529 119.0903 59.2858 28.7210 178.6369 46 K 4.3834 8.0207 118.4985 58.8257 32.1672 179.1959 47 T 3.8462 8.1233 116.6481 66.6953 68.1614 175.8365 48 M 4.0623 8.0904 119.8117 58.8515 32.1916 177.7908 49 E 3.7663 7.9263 118.6728 59.1947 29.6733 179.1404 50 E 4.2994 8.0832 118.0621 58.5010 30.2255 178.3702 51 L 3.9967 9.4118 119.0577 58.4035 41.6178 178.1371 52 E 4.1057 9.3799 120.2630 58.5593 29.1306 178.3027 53 R 3.9422 7.8851 119.7887 60.1832 30.6360 178.7523 54 T 3.9700 8.0924 115.0365 66.7553 68.5201 176.3672 55 F 4.2117 8.0854 119.3369 60.9556 39.1927 177.8052 56 R 4.0954 8.7081 117.8262 59.3638 29.5816 178.4034 57 F 4.2760 7.9883 119.2539 60.4763 39.8174 177.4273 58 I 3.4689 7.5062 118.9301 64.2750 37.0021 177.2686 59 E 3.9050 8.7004 120.1201 59.7379 29.1783 179.9717 60 D 4.7762 7.3573 114.3614 54.0908 41.7994 176.3815 61 L 4.3743 8.2750 118.8337 55.9447 45.6067 177.8788 62 A 3.9419 8.6535 122.0579 55.2691 18.2877 178.5110 63 M 4.5768 7.8756 109.8791 55.6232 31.7431 176.4955 64 R 4.4246 7.8168 115.6976 55.4949 30.3579 176.3567 65 G 3.9992 7.6190 103.4338 47.3474 0.0000 174.1830 66 G 4.1367 7.4329 104.4063 43.7083 0.0000 171.3200 67 T 4.4038 8.4053 113.5875 61.2801 70.9006 173.4215 68 I 4.9453 8.2155 123.0276 59.5053 40.3776 174.5958 69 L 4.7573 8.6407 129.7838 54.5326 43.3235 175.2685 70 F 5.2206 9.4651 125.6250 56.4391 41.3607 175.1648 71 V 4.8322 8.7760 122.3780 61.3394 34.7002 174.4447 72 G 4.4737 8.7851 111.5463 45.9076 0.0000 173.6843 73 T 5.0324 9.1298 113.6734 60.6855 70.1470 173.6295 74 K 4.4340 7.7516 122.4242 55.3693 33.9930 177.5804 75 K 3.9661 8.6506 123.5760 59.0950 32.2414 177.2571 76 Q 4.2596 8.0204 115.1938 57.2948 28.9633 176.8212 77 A 4.5901 8.3826 120.3115 52.6112 19.9063 177.9201 78 Q 4.2233 7.9961 119.1715 60.2032 29.7915 178.1790 79 D 4.3999 8.2665 117.0994 57.7425 41.0557 179.2405 80 I 3.7943 7.8202 106.6897 61.9564 37.5841 176.1199 81 V 4.1805 8.1950 122.1593 64.0427 33.5552 177.5365 82 R 3.3683 7.6653 119.5837 60.1577 29.6883 177.3051 83 M 4.3444 7.8994 120.1536 56.5509 32.0525 177.4884 84 E 3.9623 8.0114 120.1160 58.7572 30.0004 179.1843 85 A 3.6630 7.2818 120.6115 54.6197 19.3460 179.3938 86 E 3.8478 7.4025 117.0294 59.0865 29.1982 178.6016 87 R 4.3384 8.0774 116.4265 56.4255 30.1745 176.2348 88 A 4.4508 7.0500 115.9365 50.6095 21.3260 176.2710 89 G 3.9927 8.1217 103.9652 47.1130 0.0000 173.6451 90 M 4.9536 7.4910 115.1671 52.3190 36.2584 174.6013 91 P 4.9620 0.0000 0.0000 63.5543 32.7823 174.7484 92 Y 5.5410 8.2856 119.7627 56.2819 41.8967 174.3850 93 V 4.2517 9.4013 119.3913 61.7065 33.7890 175.0377 94 N 4.9624 9.0007 126.1753 54.2230 40.4848 175.1476 95 Q 4.4686 7.7123 119.7832 55.3207 29.8150 175.8512 96 R 3.9495 8.2795 122.8937 56.8522 29.5332 176.8053 97 W 4.2375 8.4868 134.5849 56.6528 28.2480 175.1631 98 L 3.7616 7.4906 121.8305 54.1259 42.1583 177.5768 99 G 3.6183 8.2861 110.1998 45.5077 0.0000 173.5884 100 G 3.9809 9.9554 105.6085 46.3102 0.0000 175.2521 101 M 3.7385 7.2518 120.2969 58.2482 31.9014 178.6917 102 L 4.2671 7.9934 116.5156 57.7514 42.6213 178.1408 103 T 4.0244 8.7631 115.3191 66.2481 69.4032 174.6268 104 N 5.0692 8.5745 120.1632 52.4300 37.8652 174.2526 105 F 4.8780 7.8262 126.3715 60.5039 39.9061 176.1076 106 K 3.8681 7.5550 120.7654 58.8211 32.9648 177.5633 107 T 4.6573 7.5156 110.4080 63.1130 69.7677 176.7942 108 I 3.6953 7.4659 122.4023 64.0285 37.0117 178.4416 109 S 4.0027 8.1453 116.2911 61.7004 62.4623 176.6101 110 Q 3.9962 7.7875 119.8667 58.4988 28.3497 179.0129 111 R 4.0680 8.1340 119.6185 58.4031 30.1758 178.9081 112 V 3.5495 7.8903 118.7794 66.4103 30.2796 177.3562 113 H 4.5834 8.3156 113.5910 56.9582 28.5492 176.2427 114 R 4.4458 7.7970 119.9735 56.8365 30.8310 177.6891 115 L 3.9687 8.0082 121.0479 57.9203 41.6865 178.0779 116 E 4.1753 8.0270 115.8746 58.1069 29.8259 178.2111 117 E 4.0598 7.4998 117.6077 58.5272 29.4149 177.9102 118 L 4.5689 7.3183 117.5349 55.5514 42.8153 178.2434 119 E 3.7669 8.2473 119.1254 59.0792 29.6406 178.1520 120 A 4.3947 7.8347 119.6112 53.7464 18.7434 177.6904 121 L 4.3938 7.2505 117.3981 56.3737 42.8689 177.8477 122 F 4.7261 7.8305 117.2619 58.6444 39.9519 175.4734 123 A 3.8854 7.9613 132.4680 52.2438 17.3052 176.3244 124 S 4.5011 7.5059 112.8521 58.0513 65.2263 174.2716 125 P 4.5822 0.0000 0.0000 63.2353 31.1726 177.3146 126 E 4.2761 7.9271 118.7587 58.1639 29.7874 177.9819 127 I 4.0857 7.4569 118.2983 62.1102 37.8026 176.2558 128 E 4.0464 7.5443 119.8441 58.4930 30.1478 176.9721 129 E 4.5251 7.4008 118.3496 55.1783 30.0110 173.4618 130 R 3.6916 8.8037 131.6088 55.8460 28.2899 174.1844 131 P 4.3781 0.0000 0.0000 62.4585 31.6439 177.1978 132 K 3.9348 8.6224 119.0370 59.3216 31.8004 178.4790 133 K 3.9763 8.0149 118.6218 59.9012 32.1224 178.6825 134 E 4.1194 8.1392 117.9440 58.8529 29.4993 179.6905 135 Q 3.9775 7.9393 118.4082 58.8977 29.0149 178.2991 136 V 3.6257 7.5412 119.3147 66.3127 31.5364 177.5593 137 R 3.9366 8.1416 118.8137 59.0854 29.9607 178.2130 138 L 4.2020 8.6895 119.1721 58.0380 41.7668 179.6903 139 K 3.9817 8.0576 118.1156 59.3076 31.9445 178.3545 140 H 3.9374 8.3822 118.2623 59.7590 29.9407 176.7201 141 E 3.8759 8.7027 121.0073 59.3424 29.2902 178.5831 142 L 4.0033 7.9225 120.3181 57.7828 42.1258 178.4762 143 E 3.8801 8.5651 119.3069 59.4173 29.4178 179.6077 144 R 3.4836 8.1309 115.9190 59.1404 29.6656 178.2240 145 L 3.8166 7.5111 121.4164 57.8299 41.8028 178.7793 146 Q 3.8450 8.2786 119.2485 59.1481 28.8399 177.7722 147 K 3.7439 7.7779 119.4886 59.8537 32.1584 177.2591 148 Y 4.8216 7.7828 114.1834 58.3859 38.1707 176.3571 149 L 4.8622 7.4959 119.3936 54.4210 42.4506 178.6499 150 S 3.9559 7.9269 118.2291 61.0076 62.9737 175.7240 151 G 3.1156 7.6058 105.8766 44.9071 0.0000 173.0932 152 F 4.5468 7.4358 121.3279 58.2935 39.8134 176.3075 153 R 3.9242 7.7938 117.7246 53.8869 31.3555 181.1440 154 L 3.3747 8.4875 120.7401 56.0553 42.8660 177.9041 155 L 4.2652 8.8397 126.8586 55.0794 42.7375 177.5185 156 K 4.6300 8.4102 126.7482 54.7991 31.4707 176.1749 157 R 4.4606 7.0250 116.5265 54.7185 33.2857 173.9786 158 L 3.7139 8.2343 122.8312 54.1591 41.1816 175.3295 159 P 4.1334 0.0000 0.0000 62.7054 31.5992 177.0159 160 D 4.3294 8.5258 122.2693 56.6284 41.4991 175.4563 161 A 4.8361 7.5877 119.2223 51.6521 23.8591 174.8727 162 I 4.9637 8.3623 111.0711 59.7189 41.2568 173.9199 163 F 5.6434 8.8138 128.4327 55.9197 41.4572 174.4761 164 V 4.7123 7.1239 123.8466 61.9142 35.3008 174.6575 165 V 3.8007 8.3342 121.5159 62.1048 32.1692 179.0155 166 D 4.4156 9.3479 135.0000 53.5016 40.5437 173.5644 167 P 4.1086 0.0000 0.0000 65.6896 31.1396 178.2749 168 T 3.8537 7.7696 108.2834 64.2725 68.8609 175.9475 169 K 4.0073 7.9218 122.8830 58.2304 33.1425 178.3941 170 E 4.3882 7.6667 118.0672 56.0446 29.6005 178.1577 171 A 4.0177 7.6075 124.1554 54.3948 18.7814 179.0473 172 I 3.5664 7.7645 117.9283 64.9404 37.2012 177.5855 173 A 2.5800 7.2576 120.3241 54.6867 17.8258 179.3312 174 V 3.3176 7.3579 115.8001 66.2477 31.3579 178.4013 175 R 3.7620 8.3993 118.3525 59.4093 29.9805 177.8585 176 E 4.2271 8.4089 119.3945 58.9836 29.6291 179.4085 177 A 4.0294 8.0964 120.1160 55.4069 18.3161 179.6904 178 R 3.7094 8.0694 117.2763 59.2745 29.9526 178.3795 179 K 4.0309 8.6474 118.3762 57.9699 32.3473 177.5986 180 L 4.6539 7.3858 116.5499 54.1196 42.3625 176.9391 181 F 3.6828 7.5379 116.7583 57.4518 37.1358 174.7936 182 I 3.9725 7.6972 122.7090 60.6365 37.4036 174.4106 183 P 4.3301 0.0000 0.0000 63.2633 32.7436 175.3571 184 V 4.8970 8.2579 122.3265 61.0444 34.5068 173.9594 185 I 5.6238 9.0124 121.2795 58.8425 40.5572 174.3657 186 A 3.9980 7.9815 123.0135 51.4199 22.4778 175.2320 187 L 5.3570 9.0095 123.7003 53.0449 41.5069 175.4590 188 A 4.7230 8.1716 126.7310 49.6965 21.8769 175.2024 189 D 5.1046 8.0013 119.2751 53.1244 40.0670 177.5231 190 T 3.3581 8.1892 104.7270 63.9560 69.3500 176.2638 191 D 4.3820 7.8653 120.5134 55.8807 41.4643 175.7969 192 S 4.5949 6.8450 113.2816 56.4120 65.5856 173.2441 193 D 4.5256 8.4099 124.1747 51.6047 39.1596 173.8650 194 P 4.1534 0.0000 0.0000 65.3890 31.6026 180.1751 195 D 4.0973 6.9668 119.9427 55.9369 41.8273 178.0427 196 L 4.3259 7.5897 116.0246 55.7454 40.6587 176.1612 197 V 4.2430 7.5994 119.1453 61.6392 33.5239 174.8422 198 D 4.1393 8.7485 127.4279 57.1009 41.1714 176.0685 199 Y 4.6991 8.3422 117.0532 56.1298 40.7440 174.4530 200 I 4.5201 8.5377 125.2174 59.7285 39.4999 175.7596 201 I 4.3118 8.8240 129.5700 58.8513 38.0104 172.3262 202 P 5.1237 0.0000 0.0000 62.8600 31.1519 175.5583 203 G 4.0694 9.0446 111.9611 45.8167 0.0000 170.1745 204 N 4.1653 8.7619 118.1929 53.2735 39.7307 173.5960 205 D 4.8550 8.1587 120.9787 53.0612 40.5270 174.9057 206 D 4.5523 7.7897 116.7207 56.1060 43.4040 175.8305 207 A 4.0438 7.7556 121.0820 52.3549 18.7826 178.3916 208 I 3.8472 8.4419 123.8257 64.1000 37.0120 177.7163 209 R 3.9319 7.8680 119.9306 59.5311 29.5154 178.3372 210 S 4.2990 8.0378 113.4145 61.5412 62.7153 176.9315 211 I 3.7719 7.6885 122.3148 64.4654 36.9929 177.9639 212 Q 3.9768 7.9024 120.3771 58.9966 28.5998 177.8601 213 L 4.2619 7.9851 121.1008 57.2783 41.5854 178.1860 214 I 4.4505 7.5518 118.5580 62.0895 38.3421 177.9795 215 L 4.0686 8.1644 120.3222 58.5379 41.5761 178.2475 216 S 4.7898 8.6481 113.8453 61.5368 61.9695 175.5288 217 R 4.1056 8.0427 120.6947 57.8154 30.1466 178.6240 218 A 4.6565 7.6427 121.4157 54.9499 18.6881 179.7273 219 V 3.6931 8.0266 116.3748 65.4462 31.6437 178.1344 220 D 4.3067 8.6397 119.5003 57.3335 40.5938 178.1434 221 L 4.0797 7.4467 118.5614 56.9854 41.8295 178.7310 222 I 3.8477 7.4340 119.8011 65.0535 37.2006 178.2487 223 I 3.8987 7.4645 119.2053 63.8001 37.2612 178.0157 224 Q 4.3087 7.8281 118.4409 56.3759 28.0137 175.6056 225 A 4.7930 7.5118 116.3059 50.9757 19.7088 177.6391 226 R 4.5176 8.1937 117.6315 57.1438 34.8596 175.1412 227 G 3.9731 7.5315 106.1537 46.5385 0.0000 171.8849 228 G 3.2922 8.9641 111.7559 44.6359 0.0000 173.9358 229 V 3.4416 7.9028 120.2041 63.4040 31.6023 175.2172 230 V 4.5866 8.0187 120.6648 59.3536 34.7781 174.6346 231 E 4.3415 8.3704 118.2358 54.8662 30.7019 173.7704 232 P 4.3559 0.0000 0.0000 62.9972 31.7765 175.6901 233 S 4.7432 8.1084 113.5749 55.3573 65.0949 172.0379 234 P 4.2541 0.0000 0.0000 63.8753 30.9571 174.8726 235 S 4.5198 8.6249 115.5347 59.7505 67.2186 173.9697 236 Y 4.2589 8.0709 118.6302 57.0130 38.1080 174.6564 237 A 4.7907 8.5295 124.6122 53.3936 25.1820 177.2300 238 L 4.4283 7.6737 112.1140 56.7606 41.5808 176.3970 239 V 3.7984 7.8163 120.8148 63.8813 29.3358 175.3685 240 Q 3.4040 8.2374 128.1933 57.0610 28.3864 173.5866 *241 E 4.1630 8.7493 115.1999 56.1592 30.4602 178.0389 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 7 V 7.91 4.07 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 0.95 0.00 0.00 0.91 0.00 0.00 8 K 8.08 3.86 0.00 1.89 1.85 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.53 7.81 9 E 8.98 4.33 0.00 1.93 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 2.40 2.23 0.00 10 L 7.83 4.00 0.00 1.60 1.72 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.61 4.09 0.00 1.96 1.57 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.78 3.88 0.00 2.03 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 2.38 2.47 0.00 13 A 8.17 3.58 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 14 G 7.39 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 0.00 0.00 0.00 15 V 7.26 4.65 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 0.68 0.00 0.00 0.85 0.00 0.00 16 H 8.60 4.85 0.00 3.18 3.33 0.00 5.79 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 8.58 4.93 0.00 3.17 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 18 G 8.65 3.45 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 0.00 19 H 7.83 4.81 0.00 3.06 2.74 0.00 5.98 0.00 0.00 0.00 0.00 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.57 3.68 0.00 1.95 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 2.45 2.37 0.00 21 R 8.26 4.90 0.00 2.02 1.98 0.00 3.13 0.00 0.00 3.30 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 22 K 9.23 3.81 0.00 1.92 1.95 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.57 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 1.28 7.81 23 R 7.95 4.66 0.00 1.79 1.92 0.00 3.26 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 24 W 8.22 4.44 0.00 3.47 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 25 N 7.90 3.55 0.00 2.44 2.61 0.00 0.00 6.66 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 26 P 0.00 2.97 0.00 1.93 1.77 0.00 3.29 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 27 K 7.95 3.90 0.00 1.79 1.86 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.31 7.81 28 F 7.76 4.64 0.00 2.97 3.12 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 29 A 7.85 4.43 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 30 R 7.64 3.86 0.00 1.65 1.85 0.00 2.51 0.00 0.00 2.90 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 31 Y 6.73 4.92 0.00 1.75 2.21 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 32 I 7.16 4.43 2.06 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 1.45 0.58 1.04 0.00 0.00 33 Y 9.15 4.31 0.00 2.95 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 34 A 7.03 4.17 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 35 E 7.96 5.18 0.00 1.67 1.66 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 2.14 2.15 0.00 36 R 8.23 4.06 0.00 1.95 1.79 0.00 3.54 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 37 N 10.10 4.29 0.00 2.86 2.82 0.00 0.00 7.38 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.33 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.95 3.83 1.89 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 1.25 0.51 0.90 0.00 0.00 40 H 8.45 4.77 0.00 3.72 3.32 0.00 5.78 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 9.23 4.30 2.08 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 1.14 0.30 1.14 0.00 0.00 42 I 8.37 4.19 2.11 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 1.36 0.85 1.06 0.00 0.00 43 D 8.73 4.70 0.00 2.90 2.72 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 0.00 0.00 0.00 44 L 8.68 4.21 0.00 1.76 1.71 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.35 3.92 0.00 2.12 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 46 K 8.02 4.38 0.00 1.97 1.89 0.00 1.98 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.71 7.81 47 T 8.12 3.85 4.39 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 1.25 0.00 0.00 48 M 8.09 4.06 0.00 2.26 2.06 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 2.70 2.67 0.00 49 E 7.93 3.77 0.00 2.18 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 2.37 2.57 0.00 50 E 8.08 4.30 0.00 2.10 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 2.24 2.20 0.00 51 L 9.41 4.00 0.00 2.09 1.94 1.08 0.87 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 52 E 9.38 4.11 0.00 2.09 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 2.38 2.39 0.00 53 R 7.89 3.94 0.00 1.96 2.06 0.00 3.42 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.83 0.00 54 T 8.09 3.97 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 1.19 0.00 0.00 55 F 8.09 4.21 0.00 3.27 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 56 R 8.71 4.10 0.00 1.97 2.06 0.00 3.31 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.88 0.00 57 F 7.99 4.28 0.00 2.13 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 58 I 7.51 3.47 2.02 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 1.67 0.69 0.86 0.00 0.00 59 E 8.70 3.91 0.00 2.01 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 2.29 2.33 0.00 60 D 7.36 4.78 0.00 2.82 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 61 L 8.27 4.37 0.00 1.20 1.43 0.84 0.64 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 62 A 8.65 3.94 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 63 M 7.88 4.58 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.72 0.00 64 R 7.82 4.42 0.00 1.88 1.97 0.00 3.21 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 65 G 7.62 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 66 G 7.43 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 67 T 8.41 4.40 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 68 I 8.22 4.95 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.55 0.52 0.00 0.00 69 L 8.64 4.76 0.00 1.86 1.66 1.25 1.11 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 70 F 9.47 5.22 0.00 3.31 3.18 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 0.00 71 V 8.78 4.83 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 72 G 8.79 4.47 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 0.00 0.00 0.00 73 T 9.13 5.03 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 1.41 0.00 0.00 74 K 7.75 4.43 0.00 1.95 1.97 0.00 1.49 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.50 7.81 75 K 8.65 3.97 0.00 1.75 1.90 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.43 7.81 76 Q 8.02 4.26 0.00 2.08 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 77 A 8.38 4.59 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 78 Q 8.00 4.22 0.00 2.17 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.58 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 79 D 8.27 4.40 0.00 2.70 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 80 I 7.82 3.79 1.86 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 1.31 0.54 0.88 0.00 0.00 81 V 8.19 4.18 2.32 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 1.11 0.00 0.00 1.07 0.00 0.00 82 R 7.67 3.37 0.00 1.89 1.96 0.00 3.26 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 83 M 7.90 4.34 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.50 0.00 84 E 8.01 3.96 0.00 1.77 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 2.33 2.31 0.00 85 A 7.28 3.66 0.83 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 86 E 7.40 3.85 0.00 1.95 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 2.28 2.08 0.00 87 R 8.08 4.34 0.00 1.84 1.82 0.00 3.31 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 88 A 7.05 4.45 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 89 G 8.12 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 90 M 7.49 4.95 0.00 2.42 2.01 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.64 0.00 91 P 0.00 4.96 0.00 2.24 2.05 0.00 3.91 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 92 Y 8.29 5.54 0.00 3.14 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 93 V 9.40 4.25 2.41 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 1.13 0.00 0.00 1.14 0.00 0.00 94 N 9.00 4.96 0.00 3.04 2.99 0.00 0.00 7.35 7.08 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 95 Q 7.71 4.47 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.88 0.00 0.00 0.00 0.00 0.00 2.47 2.72 0.00 96 R 8.28 3.95 0.00 1.36 1.71 0.00 3.24 0.00 0.00 3.07 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 97 W 8.49 4.24 0.00 3.18 3.13 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 98 L 7.49 3.76 0.00 1.19 1.30 0.73 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.29 3.62 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 0.00 0.00 0.00 100 G 9.96 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 0.00 101 M 7.25 3.74 0.00 1.39 1.01 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 102 L 7.99 4.27 0.00 1.82 1.83 1.40 1.04 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 0.00 103 T 8.76 4.02 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 1.27 0.00 0.00 104 N 8.57 5.07 0.00 2.75 2.82 0.00 0.00 6.86 8.12 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 0.00 105 F 7.83 4.88 0.00 3.38 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 0.00 106 K 7.55 3.87 0.00 1.81 1.82 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.49 7.81 107 T 7.52 4.66 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 1.26 0.00 0.00 108 I 7.47 3.70 1.98 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.76 0.83 0.00 0.00 109 S 8.15 4.00 0.00 3.53 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 7.79 4.00 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.56 0.00 111 R 8.13 4.07 0.00 2.09 1.99 0.00 3.31 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 112 V 7.89 3.55 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 0.97 0.00 0.00 0.99 0.00 0.00 113 H 8.32 4.58 0.00 3.25 3.31 0.00 5.83 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.80 4.45 0.00 1.93 2.01 0.00 3.35 0.00 0.00 3.10 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 115 L 8.01 3.97 0.00 1.78 1.78 0.90 1.05 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 0.00 116 E 8.03 4.18 0.00 2.21 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 0.00 2.48 2.36 0.00 117 E 7.50 4.06 0.00 2.04 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 2.48 2.50 0.00 118 L 7.32 4.57 0.00 1.82 1.72 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.25 3.77 0.00 2.15 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 2.30 2.36 0.00 120 A 7.83 4.39 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 0.00 121 L 7.25 4.39 0.00 1.83 1.69 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 122 F 7.83 4.73 0.00 3.18 3.18 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 0.00 123 A 7.96 3.89 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 0.00 124 S 7.51 4.50 0.00 3.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.58 0.00 2.24 2.23 0.00 3.72 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 1.96 0.00 126 E 7.93 4.28 0.00 2.04 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 2.38 2.31 0.00 127 I 7.46 4.09 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.64 0.87 0.00 0.00 128 E 7.54 4.05 0.00 1.99 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 2.31 2.34 0.00 129 E 7.40 4.53 0.00 2.15 1.75 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 2.25 2.24 0.00 130 R 8.80 3.69 0.00 1.95 1.98 0.00 3.39 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 131 P 0.00 4.38 0.00 2.21 2.20 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 132 K 8.62 3.93 0.00 1.84 1.86 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.54 7.81 133 K 8.01 3.98 0.00 1.80 1.80 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.47 7.81 134 E 8.14 4.12 0.00 1.99 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 2.49 0.00 135 Q 7.94 3.98 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.70 0.00 136 V 7.54 3.63 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 0.96 0.00 0.00 1.01 0.00 0.00 137 R 8.14 3.94 0.00 2.11 1.85 0.00 3.33 0.00 0.00 3.18 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 138 L 8.69 4.20 0.00 1.76 1.75 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.06 3.98 0.00 2.14 1.87 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.64 7.81 140 H 8.38 3.94 0.00 3.49 3.39 0.00 5.79 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.70 3.88 0.00 2.03 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 0.00 2.31 2.33 0.00 142 L 7.92 4.00 0.00 1.90 1.78 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.57 3.88 0.00 2.03 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 2.41 2.46 0.00 144 R 8.13 3.48 0.00 1.59 1.92 0.00 2.76 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 145 L 7.51 3.82 0.00 2.02 1.78 0.97 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 8.28 3.85 0.00 2.43 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.44 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 147 K 7.78 3.74 0.00 1.59 1.46 0.00 1.66 0.00 0.00 1.30 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.45 7.81 148 Y 7.78 4.82 0.00 2.93 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 0.00 149 L 7.50 4.86 0.00 1.93 1.71 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 150 S 7.93 3.96 0.00 3.87 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 0.00 151 G 7.61 3.12 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 0.00 0.00 0.00 152 F 7.44 4.55 0.00 2.80 3.04 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 0.00 153 R 7.79 3.92 0.00 1.81 1.68 0.00 3.44 0.00 0.00 3.23 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 154 L 8.49 3.37 0.00 1.72 1.10 1.03 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.84 4.27 0.00 1.62 1.59 0.93 0.86 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 0.00 156 K 8.41 4.63 0.00 1.83 1.92 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.43 7.81 157 R 7.03 4.46 0.00 1.74 1.71 0.00 3.24 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 158 L 8.23 3.71 0.00 1.59 1.57 0.79 1.03 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 0.00 159 P 0.00 4.13 0.00 2.24 2.13 0.00 3.50 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 160 D 8.53 4.33 0.00 2.57 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 0.00 161 A 7.59 4.84 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.36 4.96 1.91 0.00 0.00 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 1.22 0.78 0.97 0.00 0.00 163 F 8.81 5.64 0.00 2.50 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 0.00 0.00 0.00 0.00 164 V 7.12 4.71 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 0.75 0.00 0.00 0.75 0.00 0.00 165 V 8.33 3.80 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 0.67 0.00 0.00 0.95 0.00 0.00 166 D 9.35 4.42 0.00 2.75 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 0.00 167 P 0.00 4.11 0.00 2.17 2.14 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 168 T 7.77 3.85 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 1.18 0.00 0.00 169 K 7.92 4.01 0.00 1.79 1.77 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.59 7.81 170 E 7.67 4.39 0.00 1.82 1.47 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 2.23 2.35 0.00 171 A 7.61 4.02 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 0.00 172 I 7.76 3.57 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.46 1.14 0.00 0.00 173 A 7.26 2.58 -0.28 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 0.00 174 V 7.36 3.32 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 0.93 0.00 0.00 0.80 0.00 0.00 175 R 8.40 3.76 0.00 1.90 2.12 0.00 3.19 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 176 E 8.41 4.23 0.00 2.40 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.89 0.00 177 A 8.10 4.03 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 0.00 178 R 8.07 3.71 0.00 2.07 1.93 0.00 2.90 0.00 0.00 2.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 179 K 8.65 4.03 0.00 1.73 1.96 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.48 7.81 180 L 7.39 4.65 0.00 1.82 1.77 1.04 1.31 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 0.00 181 F 7.54 3.68 0.00 3.17 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 0.00 182 I 7.70 3.97 2.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 1.05 0.00 0.00 183 P 0.00 4.33 0.00 2.37 2.11 0.00 3.84 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 184 V 8.26 4.90 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 0.93 0.00 0.00 0.89 0.00 0.00 185 I 9.01 5.62 2.29 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 1.20 0.00 0.00 186 A 7.98 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 9.01 5.36 0.00 1.42 1.41 0.97 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 188 A 8.17 4.72 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 0.00 189 D 8.00 5.10 0.00 2.69 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 0.00 190 T 8.19 3.36 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 1.59 0.00 0.00 191 D 7.87 4.38 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 S 6.85 4.59 0.00 3.65 3.56 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 0.00 193 D 8.41 4.53 0.00 2.70 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 0.00 194 P 0.00 4.15 0.00 2.34 2.63 0.00 3.79 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 195 D 6.97 4.10 0.00 2.81 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 0.00 196 L 7.59 4.33 0.00 1.63 1.66 0.85 0.42 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 0.00 197 V 7.60 4.24 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 0.77 0.00 0.00 0.84 0.00 0.00 198 D 8.75 4.14 0.00 2.35 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 0.00 0.00 0.00 199 Y 8.34 4.70 0.00 2.78 2.72 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 0.00 0.00 0.00 200 I 8.54 4.52 2.02 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.55 0.91 0.00 0.00 201 I 8.82 4.31 1.94 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 1.35 1.45 0.96 0.00 0.00 202 P 0.00 5.12 0.00 1.97 1.73 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 203 G 9.04 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 0.00 204 N 8.76 4.17 0.00 2.68 2.74 0.00 0.00 6.70 8.47 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 0.00 205 D 8.16 4.85 0.00 2.69 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 0.00 206 D 7.79 4.55 0.00 2.58 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 0.00 207 A 7.76 4.04 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 0.00 208 I 8.44 3.85 1.84 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 1.84 1.29 0.85 0.00 0.00 209 R 7.87 3.93 0.00 1.78 1.90 0.00 3.28 0.00 0.00 3.10 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 210 S 8.04 4.30 0.00 3.97 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 I 7.69 3.77 1.88 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 1.52 0.67 0.94 0.00 0.00 212 Q 7.90 3.98 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 213 L 7.99 4.26 0.00 1.68 1.79 0.51 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 214 I 7.55 4.45 2.01 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 1.86 1.14 1.11 0.00 0.00 215 L 8.16 4.07 0.00 1.92 1.76 1.27 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.65 4.79 0.00 4.04 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 0.00 217 R 8.04 4.11 0.00 2.02 1.87 0.00 3.28 0.00 0.00 3.15 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 218 A 7.64 4.66 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 0.00 219 V 8.03 3.69 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 0.94 0.00 0.00 0.88 0.00 0.00 220 D 8.64 4.31 0.00 2.72 2.65 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 0.00 221 L 7.45 4.08 0.00 1.60 1.74 0.90 0.96 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 0.00 222 I 7.43 3.85 2.05 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.25 0.92 0.00 0.00 223 I 7.46 3.90 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.95 0.92 0.00 0.00 224 Q 7.83 4.31 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.42 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 225 A 7.51 4.79 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 0.00 226 R 8.19 4.52 0.00 1.71 2.02 0.00 3.24 0.00 0.00 3.22 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 227 G 7.53 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 0.00 228 G 8.96 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 0.00 0.00 0.00 229 V 7.90 3.44 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 0.80 0.00 0.00 0.91 0.00 0.00 230 V 8.02 4.59 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 0.91 0.00 0.00 231 E 8.37 4.34 0.00 2.07 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 2.24 2.32 0.00 232 P 0.00 4.36 0.00 2.11 2.11 0.00 3.66 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 2.06 2.11 0.00 233 S 8.11 4.74 0.00 3.93 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 0.00 234 P 0.00 4.25 0.00 2.19 2.17 0.00 3.72 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 1.97 1.98 0.00 235 S 8.62 4.52 0.00 3.68 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 0.00 236 Y 8.07 4.26 0.00 2.94 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 0.00 237 A 8.53 4.79 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 0.00 238 L 7.67 4.43 0.00 1.73 1.71 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 239 V 7.82 3.80 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 0.61 0.00 0.00 0.80 0.00 0.00 240 Q 8.24 3.40 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.42 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 *241 E 8.75 4.16 0.00 1.77 1.75 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 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.