NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2354 8.1476 120.2494 54.6367 32.6773 174.6131 2 K 4.7402 7.7668 125.9978 56.1904 33.1170 176.4246 3 G 3.8352 8.4821 111.0167 45.1486 0.0000 167.4819 4 D 4.3938 8.5917 131.4265 54.0860 41.2256 174.4491 5 T 3.8303 8.5945 123.7879 66.7706 68.5516 176.1633 6 K 3.7101 8.1881 120.8300 59.5397 32.0433 178.7242 7 V 3.8937 8.1157 117.9117 66.2795 31.6575 178.1815 8 I 3.7865 7.7895 119.2500 63.9921 36.8101 178.2872 9 N 4.2907 8.1347 117.8725 56.3103 38.3436 176.9689 10 Y 4.0734 7.8789 118.0747 61.0711 37.9196 178.6418 11 L 3.8623 8.2515 120.0118 58.0415 41.7923 179.4834 12 N 4.2811 8.0634 116.0382 55.9358 38.3995 177.5268 13 K 3.9112 7.9359 121.2980 59.3389 32.2920 178.9624 14 L 4.0146 8.0562 119.7104 57.5801 41.4031 179.1772 15 L 3.9795 7.6918 120.5177 58.0216 42.1184 179.2518 16 G 3.5888 7.9517 105.5769 47.8833 0.0000 175.2645 17 N 4.3616 8.0222 118.9515 56.1352 38.5124 177.3355 18 E 4.0638 8.1542 119.8085 59.4965 29.3967 179.2632 19 L 4.0215 8.1445 119.3353 57.9225 41.6360 180.1058 20 V 3.6246 7.8073 118.3811 64.6842 31.3910 178.3664 21 A 3.8652 7.8970 121.8031 54.6886 18.2186 179.6366 22 I 3.8401 8.0790 111.8697 64.3137 37.7462 178.3406 23 N 4.3765 7.9312 118.2611 56.0591 38.4174 177.2708 24 Q 3.8846 8.2592 121.0679 59.3799 29.1533 177.7942 25 Y 4.4387 8.1020 117.8787 60.9788 37.9401 178.1264 26 F 3.9833 8.5721 121.8811 60.9220 39.4714 177.1882 27 L 3.9927 8.0513 119.8949 58.3553 41.8818 178.5099 28 H 3.7979 8.2746 115.9480 58.6898 28.5958 177.2405 29 A 4.1659 8.0136 122.3921 55.7505 18.2038 180.0989 30 R 3.8189 7.6682 115.6078 59.0815 30.0585 179.3961 31 M 3.4549 7.6594 119.0557 57.9245 31.8154 178.6288 32 F 4.3677 7.4830 117.8641 60.4651 39.1895 177.2609 33 K 3.7935 8.3166 119.6366 59.9036 31.6896 177.7921 34 N 4.2601 7.6640 115.4134 56.7627 38.8487 176.1614 35 W 4.7934 7.7084 117.5283 57.6508 29.3096 177.2387 36 G 4.0607 8.8539 108.6306 45.5192 0.0000 173.6885 37 L 4.6380 7.9060 122.0438 52.8335 39.4366 177.0348 38 K 3.9264 8.1185 122.6778 59.3492 32.5006 178.3234 39 R 3.8575 8.2592 119.0938 59.5119 30.0229 178.6460 40 L 4.0531 7.7568 118.3148 57.4933 41.5766 178.8646 41 N 4.4453 8.1687 116.9306 56.7973 38.8446 176.5725 42 D 4.3490 8.2034 120.4229 57.4259 41.0574 179.1568 43 V 3.3144 7.6104 118.2988 66.0969 31.4331 177.8934 44 E 3.7980 8.1105 118.2502 59.4091 29.3816 178.9790 45 Y 3.8707 8.1108 119.6386 61.0160 38.9474 177.5965 46 H 4.0565 7.9345 119.1406 59.0344 29.7852 177.0802 47 E 3.6901 7.6011 120.2928 58.9557 29.0623 179.1104 48 S 4.0900 7.3847 113.4131 61.4485 62.5185 176.3470 49 I 3.6377 7.2294 122.0869 64.1060 36.6479 178.2201 50 D 4.1550 7.8346 119.8351 57.4246 40.6035 178.5086 51 E 4.0216 8.2944 119.2526 59.8475 29.3370 179.3535 52 M 4.0432 8.1479 118.5709 58.4454 31.9409 178.9487 53 K 4.0553 7.9079 118.3241 59.2377 32.2334 179.1489 54 H 4.1236 8.3311 116.7305 58.7711 28.6423 177.4219 55 A 4.2192 8.3036 122.7116 55.5428 18.2450 179.1317 56 D 4.3088 7.9322 116.1899 57.4731 41.1682 178.6941 57 R 3.8395 7.7478 118.2363 59.4286 30.0401 178.6256 58 Y 4.2829 7.5406 115.8887 61.2746 38.0384 178.4734 59 I 3.7982 8.0563 120.7639 64.7536 37.2164 178.3755 60 E 4.0788 8.2865 119.2334 59.1511 29.3245 179.3647 61 R 4.0012 8.1373 118.8959 59.5325 30.1995 178.5718 62 I 3.7952 8.3040 120.0623 64.5455 36.9820 178.4660 63 L 4.0908 7.9817 119.5172 57.5414 41.1787 179.3926 64 F 4.2665 8.1030 119.8401 61.3421 39.8077 176.9083 65 L 4.5812 7.9264 118.1131 54.5639 41.4882 176.6156 66 E 3.5722 7.8670 117.3567 57.8514 26.6528 173.4270 67 G 4.1693 8.3279 107.2653 43.4573 0.0000 172.1722 68 L 4.6401 8.0804 120.2070 52.1013 43.7240 174.3738 69 P 4.3824 0.0000 0.0000 62.8181 31.8043 175.6824 70 N 4.7113 9.2561 121.7074 52.4953 38.5541 173.9540 71 L 4.6853 8.3525 124.6102 54.5384 42.3815 177.3730 72 Q 4.2137 8.3335 122.2918 57.3703 29.6817 175.6821 73 D 4.6789 8.0927 117.7250 52.8639 41.7539 175.2168 74 L 4.6222 8.3543 125.9534 53.0764 44.1812 176.2077 75 G 3.9676 8.2041 113.6933 43.9985 0.0000 172.7206 76 K 4.1443 8.3471 118.8898 55.8887 32.5067 176.7094 77 L 4.3439 8.3986 124.1524 53.3554 42.6803 175.8485 78 N 4.7096 8.3901 122.7891 51.7571 38.2053 174.3981 79 I 3.7994 7.7964 125.9805 62.2802 37.8805 177.3655 80 G 4.3029 8.2314 107.8577 45.7786 0.0000 172.8294 81 E 4.7189 8.7788 119.8211 55.9368 30.8908 176.3759 82 D 4.9856 7.8034 118.9892 50.4508 43.8130 176.2990 83 V 4.0762 8.6541 121.6100 65.6873 30.9965 178.2180 84 E 3.8720 8.2226 119.2526 58.7109 29.5635 178.3453 85 E 3.9723 8.4740 119.4433 59.4517 29.7873 178.4865 86 M 4.2192 8.4890 119.1430 58.6681 32.0714 178.7779 87 L 4.2081 8.4332 119.2645 58.0479 41.7942 179.9222 88 R 4.0212 7.8993 118.0013 59.0385 29.9392 179.3581 89 S 4.1275 8.0543 114.7157 61.7704 62.9204 176.1882 90 D 4.2580 8.1209 121.5785 57.3905 40.5740 178.9198 91 L 3.9895 7.9980 120.4171 58.0844 42.1728 178.7936 92 A 4.0017 8.0764 120.7664 55.0180 18.3204 179.3384 93 L 3.8804 8.0185 118.7413 58.4504 42.2169 178.9933 94 E 4.0625 8.1354 118.4320 59.4674 29.3575 179.4794 95 L 4.0369 8.1245 118.9441 57.8571 41.6451 179.2657 96 D 4.4647 8.3116 118.9670 57.2834 40.7392 179.0470 97 G 3.6315 8.1901 105.9512 47.8624 0.0000 175.3827 98 A 4.0277 8.1556 123.5180 54.7792 18.0935 179.5950 99 K 3.8961 7.9296 117.5767 59.8528 32.2962 178.8583 100 N 4.3964 7.9797 116.4056 56.0980 38.3488 177.3443 101 L 3.9924 8.0466 120.5597 58.0307 41.8950 179.8290 102 R 3.8861 8.0491 117.8428 59.0629 29.8204 178.7663 103 E 3.8384 7.8970 118.7694 59.2703 29.6948 178.8152 104 A 2.8662 7.6444 120.7093 54.8079 17.8251 179.6985 105 I 3.7731 7.9982 118.7448 64.4056 37.0027 178.9565 106 G 3.6231 7.9632 106.2999 47.7971 0.0000 175.2729 107 Y 3.9474 7.7633 121.8238 60.3839 38.7725 177.6098 108 A 3.8822 7.9768 121.7481 55.1297 18.3405 179.1414 109 D 4.1408 7.6898 115.4108 57.5698 41.1243 178.4555 110 S 3.9702 7.3046 114.6389 61.4389 62.9751 176.5157 111 V 3.6329 6.9565 118.0843 61.6973 31.5499 176.3491 112 H 2.9566 7.2410 115.6336 56.7714 26.7934 176.1326 113 D 4.4957 7.5197 122.0419 53.4568 38.5435 176.1199 114 Y 4.3734 7.5026 121.7156 60.3265 38.3893 177.4817 115 V 3.7253 7.8507 119.1106 65.8583 31.7968 178.1555 116 S 4.2357 8.3757 115.2285 61.4275 62.7622 176.7384 117 R 4.0672 8.1496 118.7412 58.7690 29.0758 178.5778 118 D 4.2573 8.1955 119.2948 57.5029 41.3123 177.6059 119 M 4.0007 7.9544 118.6893 59.1228 32.1338 178.0615 120 M 4.1166 8.0073 118.4784 58.5761 32.1159 178.8985 121 I 3.7461 7.7338 119.3975 64.0276 37.0228 178.4715 122 E 3.9307 7.9209 119.8616 59.5765 29.3816 179.4013 123 I 3.6134 7.6661 119.8444 64.1734 37.0775 178.3346 124 L 4.0036 8.2618 121.6246 58.0110 41.6880 178.9539 125 R 3.9290 7.8405 118.0318 59.3384 30.2641 178.0504 126 D 4.4544 7.7848 118.9294 57.2294 40.7844 178.4295 127 E 3.9367 8.1814 119.0436 59.6047 29.4428 179.3402 128 E 4.1629 8.4558 118.1181 58.7599 29.2789 179.4622 129 G 3.7150 7.9263 106.1723 47.6403 0.0000 175.7768 130 H 4.5804 8.0030 118.0466 58.8569 28.8206 177.7524 131 I 3.8670 8.3251 122.1362 64.4003 36.9296 178.0293 132 D 4.3592 8.1076 118.9016 56.9988 41.0781 178.0947 133 W 4.1727 8.1983 128.7888 60.4206 30.6996 177.9866 134 L 3.6228 8.1119 118.5985 57.7615 40.9812 179.2483 135 E 3.9110 8.1153 118.4536 59.7872 29.5305 179.6615 136 T 3.8282 7.8829 115.5373 66.5362 68.4548 176.5163 137 E 3.7943 7.7549 120.3886 59.5012 29.0928 179.5231 138 L 3.8164 7.7876 118.7530 57.7609 41.5889 179.3260 139 D 4.4162 7.7683 118.9717 56.8986 40.7922 178.7464 140 L 4.0614 7.7009 119.3047 57.7900 41.6058 179.5599 141 I 3.4969 7.1959 119.4379 64.1467 36.6949 178.3018 142 Q 3.8748 7.2440 118.2105 59.0951 28.9825 178.0810 143 K 4.1585 8.2415 118.9234 58.7833 32.4020 178.3725 144 M 4.3924 8.5578 114.9869 54.2060 32.5391 177.3153 145 G 4.0527 7.4998 105.5951 45.6141 0.0000 174.3729 146 L 4.0262 8.3566 120.6962 58.1430 42.1372 179.3969 147 Q 4.1064 8.0239 117.6275 58.9801 28.7193 178.2661 148 N 4.3960 8.1124 117.1784 56.2713 38.4825 176.7024 149 Y 3.9608 7.7694 119.7990 60.6477 39.2244 177.8459 150 L 4.1078 8.5534 120.3204 57.9107 41.9276 179.3123 151 Q 3.9885 8.2291 119.2082 58.8535 28.7486 177.3538 152 A 4.2331 7.6232 118.9411 53.0080 18.6114 178.0334 153 Q 4.4145 7.7009 116.5750 55.5853 30.1284 177.0635 154 I 4.1864 7.0681 110.8792 61.6708 37.7850 176.2309 155 R 4.6295 7.4385 119.9735 54.2620 33.7686 174.6230 156 E 4.1412 8.5980 120.4452 55.8640 30.6617 177.3425 157 E 4.0882 8.2961 121.5024 55.5763 31.5059 176.8390 *158 G 3.7267 8.5798 107.7373 46.1105 0.0000 172.6579 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.15 4.24 0.00 1.28 1.77 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 2 K 7.77 4.74 0.00 1.92 1.88 0.00 1.23 0.00 0.00 2.34 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 3 G 8.48 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.59 4.39 0.00 2.97 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.59 3.83 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 1.24 0.00 0.00 6 K 8.19 3.71 0.00 1.97 1.74 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.13 7.81 7 V 8.12 3.89 2.35 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 1.25 0.00 0.00 1.20 0.00 0.00 8 I 7.79 3.79 2.00 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 1.56 1.20 0.92 0.00 0.00 9 N 8.13 4.29 0.00 2.77 2.61 0.00 0.00 6.85 7.02 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 10 Y 7.88 4.07 0.00 3.19 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.25 3.86 0.00 2.05 1.75 1.10 1.04 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 12 N 8.06 4.28 0.00 2.89 2.81 0.00 0.00 6.70 6.57 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 13 K 7.94 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 L 8.06 4.01 0.00 1.56 0.86 0.92 0.50 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 15 L 7.69 3.98 0.00 1.69 1.76 1.09 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.95 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.02 4.36 0.00 3.03 2.91 0.00 0.00 7.05 7.78 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 18 E 8.15 4.06 0.00 2.31 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 0.00 2.75 2.85 0.00 19 L 8.14 4.02 0.00 1.85 1.73 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.81 3.62 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 0.89 0.00 0.00 0.90 0.00 0.00 21 A 7.90 3.87 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.08 3.84 1.92 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 0.97 1.03 0.00 0.00 23 N 7.93 4.38 0.00 2.97 2.91 0.00 0.00 6.68 7.11 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 24 Q 8.26 3.88 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 25 Y 8.10 4.44 0.00 3.39 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.57 3.98 0.00 3.35 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 27 L 8.05 3.99 0.00 1.88 1.63 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.27 3.80 0.00 3.58 3.26 0.00 5.89 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.01 4.17 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 30 R 7.67 3.82 0.00 1.75 1.88 0.00 3.17 0.00 0.00 2.96 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.74 0.00 31 M 7.66 3.45 0.00 0.87 1.51 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 32 F 7.48 4.37 0.00 3.26 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 33 K 8.32 3.79 0.00 2.07 1.91 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 34 N 7.66 4.26 0.00 2.70 2.64 0.00 0.00 7.38 8.11 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 35 W 7.71 4.79 0.00 3.76 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 36 G 8.85 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 0.00 0.00 0.00 37 L 7.91 4.64 0.00 2.14 1.66 1.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.12 3.93 0.00 1.78 1.85 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.51 7.81 39 R 8.26 3.86 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 40 L 7.76 4.05 0.00 1.49 0.90 1.06 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.17 4.45 0.00 3.16 3.06 0.00 0.00 7.16 8.20 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 42 D 8.20 4.35 0.00 2.93 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.61 3.31 1.69 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 -0.68 0.00 0.00 0.73 0.00 0.00 44 E 8.11 3.80 0.00 2.34 2.35 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 2.66 3.15 0.00 45 Y 8.11 3.87 0.00 3.00 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 46 H 7.93 4.06 0.00 3.19 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.60 3.69 0.00 1.16 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 0.00 0.00 0.00 1.83 1.78 0.00 48 S 7.38 4.09 0.00 3.99 3.96 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 49 I 7.23 3.64 1.87 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.76 0.85 0.00 0.00 50 D 7.83 4.16 0.00 2.71 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 51 E 8.29 4.02 0.00 2.18 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 0.00 2.72 2.82 0.00 52 M 8.15 4.04 0.00 2.03 2.20 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 2.71 2.55 0.00 53 K 7.91 4.06 0.00 1.92 1.80 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.62 7.81 54 H 8.33 4.12 0.00 3.36 3.47 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.30 4.22 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 56 D 7.93 4.31 0.00 2.76 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.75 3.84 0.00 1.99 1.64 0.00 3.12 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 58 Y 7.54 4.28 0.00 3.23 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 59 I 8.06 3.80 2.05 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 1.59 1.53 0.95 0.00 0.00 60 E 8.29 4.08 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 2.35 2.70 0.00 61 R 8.14 4.00 0.00 2.14 2.22 0.00 3.31 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 1.75 1.85 0.00 62 I 8.30 3.80 1.94 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 1.59 0.76 0.96 0.00 0.00 63 L 7.98 4.09 0.00 2.12 1.79 0.98 0.90 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 64 F 8.10 4.27 0.00 3.00 3.30 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 65 L 7.93 4.58 0.00 1.99 1.68 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.87 3.57 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 2.13 2.23 0.00 67 G 8.33 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.08 4.64 0.00 1.57 1.54 0.92 0.91 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 69 P 0.00 4.38 0.00 2.10 2.01 0.00 3.72 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 2.06 2.12 0.00 70 N 9.26 4.71 0.00 2.60 2.80 0.00 0.00 7.03 7.64 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 71 L 8.35 4.69 0.00 1.64 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.33 4.21 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.09 4.68 0.00 2.68 2.57 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 74 L 8.35 4.62 0.00 1.56 1.51 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.20 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 76 K 8.35 4.14 0.00 1.75 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 77 L 8.40 4.34 0.00 1.61 1.57 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.39 4.71 0.00 2.64 2.74 0.00 0.00 7.22 7.94 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 79 I 7.80 3.80 1.90 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 1.35 0.93 1.00 0.00 0.00 80 G 8.23 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 0.00 0.00 0.00 0.00 81 E 8.78 4.72 0.00 2.04 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 2.30 2.41 0.00 82 D 7.80 4.99 0.00 2.87 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 83 V 8.65 4.08 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 1.13 0.00 0.00 1.12 0.00 0.00 84 E 8.22 3.87 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 2.25 2.22 0.00 85 E 8.47 3.97 0.00 2.47 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 86 M 8.49 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.51 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.22 0.84 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 88 R 7.90 4.02 0.00 1.99 1.99 0.00 3.12 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 89 S 8.05 4.13 0.00 4.15 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 0.00 90 D 8.12 4.26 0.00 3.09 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 91 L 8.00 3.99 0.00 1.93 1.87 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.08 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 93 L 8.02 3.88 0.00 1.87 1.79 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.14 4.06 0.00 2.34 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 2.57 2.71 0.00 95 L 8.12 4.04 0.00 2.06 1.73 0.96 1.01 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 96 D 8.31 4.46 0.00 2.87 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 97 G 8.19 3.63 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 0.00 0.00 0.00 98 A 8.16 4.03 1.44 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 0.00 0.00 0.00 99 K 7.93 3.90 0.00 1.96 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 N 7.98 4.40 0.00 2.95 2.89 0.00 0.00 7.05 8.00 0.00 0.00 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 L 8.05 3.99 0.00 1.90 1.74 0.96 0.91 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 0.00 102 R 8.05 3.89 0.00 1.86 1.97 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 103 E 7.90 3.84 0.00 2.01 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 2.27 2.36 0.00 104 A 7.64 2.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.00 3.77 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.19 0.92 0.00 0.00 106 G 7.96 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 0.00 107 Y 7.76 3.95 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.98 3.88 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 0.00 109 D 7.69 4.14 0.00 2.87 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 0.00 110 S 7.30 3.97 0.00 3.52 3.72 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 0.00 111 V 6.96 3.63 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 0.63 0.00 0.00 0.81 0.00 0.00 112 H 7.24 2.96 0.00 3.14 3.23 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.52 4.50 0.00 2.61 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 0.00 114 Y 7.50 4.37 0.00 3.09 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.85 3.73 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 1.08 0.00 0.00 0.99 0.00 0.00 116 S 8.38 4.24 0.00 4.11 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 0.00 117 R 8.15 4.07 0.00 2.14 2.33 0.00 2.91 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 118 D 8.20 4.26 0.00 3.00 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 0.00 119 M 7.95 4.00 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 120 M 8.01 4.12 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.81 0.00 121 I 7.73 3.75 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.84 0.92 0.00 0.00 122 E 7.92 3.93 0.00 2.23 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 2.32 2.54 0.00 123 I 7.67 3.61 1.92 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.83 0.73 0.00 0.00 124 L 8.26 4.00 0.00 1.85 1.86 0.94 1.15 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 0.00 125 R 7.84 3.93 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 126 D 7.78 4.45 0.00 2.99 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 0.00 127 E 8.18 3.94 0.00 2.14 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 0.00 2.61 2.55 0.00 128 E 8.46 4.16 0.00 2.25 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 2.36 2.48 0.00 129 G 7.93 3.72 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 0.00 0.00 0.00 130 H 8.00 4.58 0.00 3.65 3.63 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.33 3.87 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.83 0.97 0.00 0.00 132 D 8.11 4.36 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 W 8.20 4.17 0.00 3.45 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 0.00 134 L 8.11 3.62 0.00 1.87 1.73 1.27 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.12 3.91 0.00 2.17 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 2.33 2.66 0.00 136 T 7.88 3.83 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 137 E 7.75 3.79 0.00 1.56 1.64 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 1.47 1.47 0.00 138 L 7.79 3.82 0.00 1.66 1.61 0.88 0.88 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 0.00 139 D 7.77 4.42 0.00 2.83 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 0.00 140 L 7.70 4.06 0.00 2.07 1.85 0.93 0.75 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 0.00 141 I 7.20 3.50 1.67 0.00 0.00 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 -0.30 -0.04 0.68 0.00 0.00 142 Q 7.24 3.87 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.24 4.16 0.00 1.79 1.84 0.00 1.72 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.42 7.81 144 M 8.56 4.39 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.94 0.00 145 G 7.50 4.05 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 0.00 0.00 0.00 146 L 8.36 4.03 0.00 1.74 1.67 0.95 0.70 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 0.00 147 Q 8.02 4.11 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.40 0.00 2.95 2.89 0.00 0.00 6.77 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 0.00 149 Y 7.77 3.96 0.00 3.10 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.55 4.11 0.00 2.02 1.71 1.12 0.74 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 0.00 151 Q 8.23 3.99 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.62 4.23 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 0.00 153 Q 7.70 4.41 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 154 I 7.07 4.19 1.88 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 1.55 1.25 0.95 0.00 0.00 155 R 7.44 4.63 0.00 1.73 1.79 0.00 3.19 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 1.51 1.58 0.00 156 E 8.60 4.14 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 2.25 2.34 0.00 157 E 8.30 4.09 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 *158 G 8.58 3.73 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.