NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1812 8.1633 120.2788 54.6664 33.0990 174.1898 2 K 3.9719 8.4988 126.3682 56.2446 32.4271 175.7371 3 G 3.9392 8.6668 113.6119 44.8407 0.0000 171.9538 4 D 4.5340 8.4807 119.8342 54.4068 41.8613 176.8403 5 T 3.8796 8.9809 123.1367 66.9400 68.4938 176.4072 6 K 3.8329 8.1431 120.8129 59.2111 32.2601 178.7843 7 V 3.9165 8.6473 118.9014 66.1915 31.4228 177.8967 8 I 3.7389 7.8518 119.4262 64.6969 36.9271 178.0966 9 N 4.2721 8.2278 117.0440 56.4208 38.3130 177.0805 10 Y 4.0585 8.0594 118.1093 61.0998 38.0086 178.5346 11 L 3.8701 8.4791 120.2131 58.0657 41.6762 179.4775 12 N 4.3698 8.5375 116.6681 56.0007 38.4184 177.4826 13 K 3.8692 8.1029 121.2736 59.3681 32.3114 178.9438 14 L 3.8124 8.1546 119.6683 57.5084 41.3766 178.9388 15 L 3.9871 7.7585 120.8174 58.2505 42.0253 179.0793 16 G 3.7189 8.1863 105.6088 48.1491 0.0000 175.1943 17 N 4.3470 8.0405 118.9677 56.0669 38.5705 177.3931 18 E 3.9990 8.3576 119.9203 59.3742 29.4145 179.3748 19 L 3.9992 8.1636 119.2551 57.6415 41.5621 179.8181 20 V 3.4623 7.6455 117.4100 65.9802 31.5290 177.9157 21 A 3.2264 7.9010 120.5081 54.8018 18.0890 179.3764 22 I 3.5638 7.9836 118.6237 64.8476 37.2254 178.4021 23 N 4.3573 7.8013 116.8113 56.3411 38.3175 177.4211 24 Q 3.8766 8.1491 121.1643 59.4796 29.0838 177.8999 25 Y 4.6035 8.2873 118.2535 60.8638 37.9632 178.0864 26 F 3.8143 8.4780 121.8542 61.0442 39.5313 176.9715 27 L 3.9544 8.2071 120.0034 58.5443 41.8586 178.4581 28 H 3.8205 8.3448 116.0842 58.7131 28.5546 177.3839 29 A 4.0660 8.0969 122.5960 55.5358 18.1744 179.8693 30 R 3.8428 7.6282 115.2681 58.5427 30.1127 179.2511 31 M 3.4593 7.7346 119.2381 58.1712 31.8482 178.3831 32 F 4.6425 7.5868 118.0400 60.6509 39.0327 177.6992 33 K 3.9249 8.2637 119.1277 59.5818 31.8263 178.0994 34 N 4.2476 7.9893 116.1722 56.6642 38.9006 176.1179 35 W 4.8273 7.9785 116.8342 57.0417 29.0333 177.0968 36 G 3.9788 8.5305 108.4513 46.0390 0.0000 174.3459 37 L 4.7350 8.2064 122.7293 52.5938 40.4443 176.9732 38 K 3.8569 8.1435 123.6482 59.6702 32.5860 177.6043 39 R 3.8999 8.1399 118.7475 59.4462 29.9084 178.5323 40 L 4.0520 7.7584 118.3929 57.5161 41.5787 178.6229 41 N 4.4371 8.3294 117.1053 56.8460 38.9017 176.5101 42 D 4.3976 8.2055 120.1114 57.4882 40.9756 179.0644 43 V 3.3627 7.6435 118.3790 65.9473 31.4627 177.6726 44 E 3.8587 8.5437 119.4677 59.3259 29.4821 178.1112 45 Y 3.9430 8.4197 120.0172 61.1184 38.9670 177.8033 46 H 4.0897 8.3798 116.7483 58.2473 28.8212 177.4424 47 E 3.8263 8.1188 121.8405 58.9537 29.4501 178.5433 48 S 4.2307 8.1877 113.3582 61.5612 62.4915 176.1998 49 I 3.5761 7.5868 122.4207 64.4551 36.7725 178.0950 50 D 4.2633 7.9294 119.5394 57.5047 40.5554 178.8055 51 E 4.0678 8.1839 118.6296 59.2997 29.3623 179.2740 52 M 4.0384 7.8640 119.0192 58.2717 31.9933 178.7612 53 K 3.9043 8.0795 118.5942 59.7645 32.2193 179.0896 54 H 4.0951 8.0316 116.1481 58.7905 28.6090 177.5770 55 A 4.2282 8.3619 122.8930 55.3648 18.1677 179.1035 56 D 4.2942 8.2908 116.4732 57.6064 41.3066 178.7348 57 R 3.8639 7.9221 118.4865 59.4042 30.0529 178.6650 58 Y 4.3205 7.8375 116.4068 61.1697 37.9141 178.5770 59 I 3.7593 8.2640 121.0857 64.6887 37.1941 178.3969 60 E 4.0418 8.4067 119.3137 59.2860 29.1686 179.4845 61 R 4.0288 8.2260 118.7895 59.5212 30.1469 178.5309 62 I 3.7618 8.4087 119.9883 64.4801 37.1155 178.4557 63 L 4.0014 8.1446 119.6962 57.7694 41.2611 179.2662 64 F 4.3515 8.4202 119.7850 61.2907 39.6916 176.4143 65 L 4.5375 8.1159 117.6140 54.0008 41.1805 177.3336 66 E 3.8274 8.0087 117.6621 57.2676 27.0660 174.5813 67 G 3.9338 7.9894 108.9459 44.1426 0.0000 173.5996 68 L 4.5354 8.0162 119.2266 52.0088 42.1160 175.0883 69 P 4.3730 0.0000 0.0000 62.5271 31.7788 175.9714 70 N 4.7150 9.6553 122.3071 52.3978 38.8146 173.9951 71 L 4.6073 8.2981 124.2454 54.5275 42.4970 177.5073 72 Q 4.0904 8.5239 121.9678 58.0387 29.3077 175.8200 73 D 4.6658 8.0824 117.4430 52.6601 41.9112 175.2310 74 L 4.5244 8.2918 125.7937 52.6934 43.7719 176.1924 75 G 3.8080 8.4587 115.3363 44.6783 0.0000 171.9977 76 K 4.0317 8.3053 120.6872 56.1337 32.4436 176.4871 77 L 4.2598 8.2997 126.2904 54.4406 42.4038 176.4684 78 N 4.8024 8.7696 120.1169 51.7162 39.2098 172.5238 79 I 4.2546 8.1208 124.4329 59.7012 38.2011 176.6467 80 G 4.0453 8.7719 114.6017 45.1688 0.0000 172.7763 81 E 4.7354 8.6099 117.6579 56.1928 31.0636 176.3809 82 D 4.9140 7.7001 117.9750 50.3074 44.0580 176.0487 83 V 4.0005 8.4210 118.9336 66.5369 31.3602 177.5024 84 E 3.8618 8.1951 118.1807 59.4195 29.5140 178.2290 85 E 3.9824 8.3942 118.8521 59.4391 29.6450 178.7536 86 M 4.0495 8.2343 118.7381 58.4221 32.0191 178.7286 87 L 4.1432 8.2032 119.1036 58.0149 41.7353 179.8251 88 R 3.9335 8.4260 118.4014 59.2345 29.9616 179.1581 89 S 4.1516 8.3230 113.0205 61.4105 62.3684 175.8301 90 D 4.6931 8.4439 121.7052 57.3611 40.5675 178.4804 91 L 3.9427 8.2454 120.6051 58.3248 42.1465 178.9287 92 A 4.0272 8.3250 120.8197 55.0411 18.2697 179.3773 93 L 3.9793 8.1049 118.9265 58.3666 42.1337 179.1075 94 E 4.1149 8.6179 118.7817 59.3693 29.4671 179.3102 95 L 4.0308 8.1830 119.0939 58.0215 41.8014 179.3238 96 D 4.5138 8.3822 118.9511 57.3458 40.6446 179.1770 97 G 3.6368 8.3500 106.1110 47.6324 0.0000 175.6846 98 A 4.0255 8.4997 123.6054 54.6348 18.4930 179.4767 99 K 3.8353 8.0120 118.0457 59.9279 32.3208 178.7086 100 N 4.3892 8.0807 116.3382 56.2831 38.3995 177.3065 101 L 4.0011 8.1740 120.4973 57.9665 41.7437 179.7938 102 R 3.9009 8.2522 118.1080 59.1637 30.0295 178.6730 103 E 3.8262 8.0286 118.2859 59.3181 29.6000 178.7477 104 A 2.8918 7.7252 120.6209 54.8318 18.4110 179.6311 105 I 3.7253 8.1067 118.8701 64.3691 36.9274 178.9199 106 G 3.5774 7.7523 105.5507 47.9622 0.0000 174.8981 107 Y 4.1256 7.9864 122.0652 60.1904 38.8795 177.4308 108 A 3.7866 8.2354 122.1448 55.2528 18.3992 179.0482 109 D 4.1321 7.8215 116.0858 57.4483 41.1241 178.5127 110 S 4.1675 7.5030 112.7301 60.1338 63.2530 175.6671 111 V 3.9879 6.8522 113.9352 60.7231 31.6274 175.6014 112 H 2.7685 7.0784 114.2581 56.6014 26.9068 176.4577 113 D 4.5192 7.3088 121.3863 53.7062 37.9142 176.1283 114 Y 4.3369 7.5264 121.6402 60.3701 38.4867 177.7829 115 V 3.7173 7.8794 120.0331 64.7439 31.7282 178.4731 116 S 4.1740 8.3341 115.6672 61.2973 62.5827 176.5420 117 R 3.8897 8.0288 121.3691 59.5513 29.7775 178.0462 118 D 4.3196 8.3763 117.9349 57.5701 41.3190 177.8229 119 M 4.0027 8.2124 118.7041 59.0356 32.1636 178.1800 120 M 4.1762 8.2381 118.8459 58.2934 32.0793 178.8414 121 I 3.7280 8.1731 120.5590 64.3005 37.2463 178.2092 122 E 3.9755 8.0104 119.2063 59.4860 29.2229 179.5314 123 I 3.5478 7.5699 119.2794 64.2167 37.0636 178.1833 124 L 3.9536 8.1597 121.3963 58.1339 42.0000 178.9733 125 R 3.8988 8.1632 118.6437 59.6288 30.1569 178.2804 126 D 4.4396 8.1925 118.6789 57.4014 40.7877 178.6730 127 E 4.1365 8.4448 119.3387 59.5092 29.4486 179.2428 128 E 4.2655 8.7425 119.1787 59.1596 29.4439 179.5691 129 G 3.6879 8.0855 105.5960 48.1271 0.0000 175.2874 130 H 4.4034 8.2096 120.3835 59.0186 29.8549 177.2792 131 I 3.6973 8.3257 122.1492 64.4521 36.9564 177.7740 132 D 4.3386 8.3770 118.7909 57.0778 40.9966 178.0592 133 W 4.1027 8.2710 128.7159 60.4789 30.7394 177.6313 134 L 3.7670 8.4170 119.0616 58.0368 41.1348 179.3784 135 E 3.9002 8.4506 118.5556 59.7571 29.2987 179.7409 136 T 3.7459 7.8734 115.5169 66.5446 68.5379 176.5109 137 E 3.6796 7.7189 120.5905 59.4216 29.0137 179.4630 138 L 3.7553 7.6816 118.7696 57.8673 41.5625 179.4317 139 D 4.3362 7.9764 118.7924 57.2668 40.6602 178.7362 140 L 3.9508 8.0538 119.7450 57.7552 41.5985 179.5730 141 I 3.3687 7.3734 119.7561 64.3706 36.7454 178.2831 142 Q 3.9149 7.3356 117.8996 58.9841 28.9545 177.8952 143 K 4.1461 8.0543 119.1496 58.6537 32.3185 178.2908 144 M 4.3825 8.3222 114.9893 53.9503 32.5044 177.2558 145 G 4.1086 7.5522 105.5630 45.9597 0.0000 174.3846 146 L 3.9543 8.4085 121.5439 58.0174 42.1782 179.2858 147 Q 3.9723 8.0834 117.4577 59.3263 28.7420 178.6978 148 N 4.3490 8.1329 116.7323 56.3160 38.3792 176.6702 149 Y 3.9274 7.9264 120.1066 60.6211 39.1361 177.8462 150 L 4.0304 8.4390 120.1848 57.9585 41.6571 179.1781 151 Q 3.8828 8.0976 119.1121 59.2334 28.7204 178.0168 152 A 4.0966 7.7540 119.4567 53.6890 18.6946 178.3199 153 Q 4.2317 7.9124 116.3436 55.9181 29.2046 177.3248 154 I 4.1456 7.3178 112.6928 61.6082 38.2219 176.1891 155 R 4.6593 7.5533 119.6518 53.8275 32.4543 175.4868 156 E 4.2465 8.5667 119.4083 55.9755 30.5770 175.6146 157 E 4.4966 8.4174 117.7649 54.3918 31.7144 176.2487 *158 G 3.7097 8.5928 110.1406 45.8782 0.0000 172.3668 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 8.16 4.18 0.00 1.40 1.79 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 2 K 8.50 3.97 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.46 7.81 3 G 8.67 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 4 D 8.48 4.53 0.00 2.77 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 5 T 8.98 3.88 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 1.18 0.00 0.00 6 K 8.14 3.83 0.00 1.71 2.06 0.00 1.38 0.00 0.00 1.41 0.00 0.00 2.54 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.65 3.92 2.36 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 1.12 0.00 0.00 1.18 0.00 0.00 8 I 7.85 3.74 2.06 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 1.55 0.61 0.91 0.00 0.00 9 N 8.23 4.27 0.00 2.62 2.66 0.00 0.00 7.09 7.05 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 10 Y 8.06 4.06 0.00 3.21 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 8.48 3.87 0.00 2.02 1.77 1.13 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.54 4.37 0.00 2.77 2.81 0.00 0.00 6.70 7.87 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 13 K 8.10 3.87 0.00 1.82 1.96 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.44 7.81 14 L 8.15 3.81 0.00 0.78 1.18 0.91 0.51 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 15 L 7.76 3.99 0.00 1.69 1.83 1.05 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.19 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 17 N 8.04 4.35 0.00 2.92 2.89 0.00 0.00 7.09 7.16 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 18 E 8.36 4.00 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.86 0.00 19 L 8.16 4.00 0.00 1.79 1.68 0.90 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 20 V 7.65 3.46 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 1.08 0.00 0.00 0.95 0.00 0.00 21 A 7.90 3.23 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.98 3.56 1.96 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 1.54 0.99 0.85 0.00 0.00 23 N 7.80 4.36 0.00 2.78 2.83 0.00 0.00 6.76 8.77 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 24 Q 8.15 3.88 0.00 2.03 1.98 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 2.60 2.22 0.00 25 Y 8.29 4.60 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.48 3.81 0.00 3.41 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 27 L 8.21 3.95 0.00 1.96 1.60 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.34 3.82 0.00 3.47 2.99 0.00 5.71 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 8.10 4.07 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 30 R 7.63 3.84 0.00 1.76 1.88 0.00 3.24 0.00 0.00 3.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.67 0.00 31 M 7.73 3.46 0.00 1.01 1.63 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.18 0.00 32 F 7.59 4.64 0.00 3.29 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.26 3.92 0.00 2.07 1.89 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 34 N 7.99 4.25 0.00 2.66 2.65 0.00 0.00 7.35 8.07 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 35 W 7.98 4.83 0.00 3.74 3.14 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 36 G 8.53 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 37 L 8.21 4.74 0.00 1.89 1.62 1.19 0.59 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 38 K 8.14 3.86 0.00 2.02 1.82 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.57 7.81 39 R 8.14 3.90 0.00 2.12 2.00 0.00 3.55 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 1.81 0.00 40 L 7.76 4.05 0.00 1.69 1.09 1.09 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.33 4.44 0.00 3.10 3.01 0.00 0.00 7.20 7.92 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 42 D 8.21 4.40 0.00 2.89 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 43 V 7.64 3.36 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 -0.48 0.00 0.00 0.80 0.00 0.00 44 E 8.54 3.86 0.00 2.48 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 45 Y 8.42 3.94 0.00 2.91 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 46 H 8.38 4.09 0.00 3.26 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.12 3.83 0.00 2.10 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 1.63 1.76 0.00 48 S 8.19 4.23 0.00 4.09 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 49 I 7.59 3.58 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.46 0.83 0.00 0.00 50 D 7.93 4.26 0.00 2.99 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 51 E 8.18 4.07 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.52 0.00 52 M 7.86 4.04 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 53 K 8.08 3.90 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.63 7.81 54 H 8.03 4.10 0.00 3.41 3.32 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 8.36 4.23 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 56 D 8.29 4.29 0.00 2.91 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 57 R 7.92 3.86 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 58 Y 7.84 4.32 0.00 3.21 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 59 I 8.26 3.76 2.04 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 1.57 1.01 0.95 0.00 0.00 60 E 8.41 4.04 0.00 2.03 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 2.50 0.00 61 R 8.23 4.03 0.00 2.13 2.21 0.00 3.35 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.86 0.00 62 I 8.41 3.76 2.07 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 1.58 0.68 0.95 0.00 0.00 63 L 8.14 4.00 0.00 2.11 1.79 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.42 4.35 0.00 2.94 3.38 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 65 L 8.12 4.54 0.00 1.85 1.62 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.01 3.83 0.00 2.07 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 0.00 2.15 2.25 0.00 67 G 7.99 3.93 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 0.00 0.00 0.00 68 L 8.02 4.54 0.00 1.59 1.62 0.92 0.98 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 69 P 0.00 4.37 0.00 2.05 2.02 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 70 N 9.66 4.72 0.00 2.60 2.80 0.00 0.00 7.08 8.21 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 71 L 8.30 4.61 0.00 1.62 1.63 0.93 0.97 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 72 Q 8.52 4.09 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.08 4.67 0.00 2.67 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 74 L 8.29 4.52 0.00 1.51 1.51 0.88 1.10 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 75 G 8.46 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 0.00 0.00 0.00 76 K 8.31 4.03 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 77 L 8.30 4.26 0.00 1.65 1.57 0.88 0.96 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 78 N 8.77 4.80 0.00 2.65 2.74 0.00 0.00 7.14 7.22 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 79 I 8.12 4.25 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.95 0.95 0.00 0.00 80 G 8.77 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 81 E 8.61 4.74 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 82 D 7.70 4.91 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 83 V 8.42 4.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.20 0.00 0.00 84 E 8.20 3.86 0.00 2.00 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 2.34 2.28 0.00 85 E 8.39 3.98 0.00 2.41 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 2.36 2.39 0.00 86 M 8.23 4.05 0.00 1.79 2.41 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.39 0.00 87 L 8.20 4.14 0.00 2.02 1.71 1.25 0.75 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 88 R 8.43 3.93 0.00 1.86 2.00 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 89 S 8.32 4.15 0.00 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 0.00 90 D 8.44 4.69 0.00 3.06 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 91 L 8.25 3.94 0.00 1.84 1.89 0.94 0.92 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 92 A 8.32 4.03 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 93 L 8.10 3.98 0.00 1.99 2.05 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.62 4.11 0.00 2.25 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 2.69 2.49 0.00 95 L 8.18 4.03 0.00 2.05 1.75 0.95 0.99 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 96 D 8.38 4.51 0.00 2.87 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 97 G 8.35 3.64 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 0.00 0.00 0.00 98 A 8.50 4.03 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 99 K 8.01 3.84 0.00 2.13 1.90 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 N 8.08 4.39 0.00 3.01 2.90 0.00 0.00 7.11 6.61 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 0.00 101 L 8.17 4.00 0.00 1.97 1.75 1.01 1.31 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 0.00 102 R 8.25 3.90 0.00 1.98 1.98 0.00 3.14 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 1.66 1.92 0.00 103 E 8.03 3.83 0.00 2.08 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 2.38 0.00 104 A 7.73 2.89 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.11 3.73 2.03 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 0.97 0.92 0.00 0.00 106 G 7.75 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.99 4.13 0.00 3.16 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 0.00 108 A 8.24 3.79 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 0.00 109 D 7.82 4.13 0.00 2.86 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 0.00 110 S 7.50 4.17 0.00 4.00 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 0.00 111 V 6.85 3.99 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 0.54 0.00 0.00 0.64 0.00 0.00 112 H 7.08 2.77 0.00 3.15 3.27 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.31 4.52 0.00 2.63 2.46 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 0.00 114 Y 7.53 4.34 0.00 3.11 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 0.00 115 V 7.88 3.72 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 0.97 0.00 0.00 0.97 0.00 0.00 116 S 8.33 4.17 0.00 4.20 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 0.00 117 R 8.03 3.89 0.00 1.91 2.20 0.00 3.33 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 118 D 8.38 4.32 0.00 2.97 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 0.00 119 M 8.21 4.00 0.00 2.25 2.02 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 2.44 0.00 120 M 8.24 4.18 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.84 0.00 121 I 8.17 3.73 1.88 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 1.54 0.83 0.92 0.00 0.00 122 E 8.01 3.98 0.00 2.09 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 2.50 0.00 123 I 7.57 3.55 1.94 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.53 0.73 0.00 0.00 124 L 8.16 3.95 0.00 1.85 1.86 0.95 1.07 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 0.00 125 R 8.16 3.90 0.00 2.07 2.12 0.00 3.16 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 1.64 1.69 0.00 126 D 8.19 4.44 0.00 3.01 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 0.00 127 E 8.44 4.14 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.57 0.00 128 E 8.74 4.27 0.00 2.03 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 2.52 0.00 129 G 8.09 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.21 4.40 0.00 3.38 3.56 0.00 5.62 0.00 0.00 0.00 0.00 6.92 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 3.70 2.06 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 1.45 0.67 0.94 0.00 0.00 132 D 8.38 4.34 0.00 2.95 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 0.00 133 W 8.27 4.10 0.00 3.52 3.44 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 0.00 134 L 8.42 3.77 0.00 2.01 1.70 1.20 1.16 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 0.00 135 E 8.45 3.90 0.00 2.09 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 2.31 2.49 0.00 136 T 7.87 3.75 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 137 E 7.72 3.68 0.00 1.49 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 0.00 1.47 1.47 0.00 138 L 7.68 3.76 0.00 1.69 1.60 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.98 4.34 0.00 2.77 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 0.00 140 L 8.05 3.95 0.00 1.83 1.82 0.93 1.08 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 0.00 141 I 7.37 3.37 1.71 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 -0.30 0.71 0.00 0.00 142 Q 7.34 3.91 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.05 4.15 0.00 1.74 1.83 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 144 M 8.32 4.38 0.00 2.17 2.19 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 2.65 2.85 0.00 145 G 7.55 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 0.00 146 L 8.41 3.95 0.00 1.74 1.66 0.94 0.69 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 0.00 147 Q 8.08 3.97 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 148 N 8.13 4.35 0.00 2.96 2.88 0.00 0.00 6.67 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 7.93 3.93 0.00 3.00 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 0.00 150 L 8.44 4.03 0.00 1.99 1.68 1.02 1.01 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 0.00 151 Q 8.10 3.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 152 A 7.75 4.10 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 0.00 153 Q 7.91 4.23 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 154 I 7.32 4.15 1.87 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 1.56 1.19 0.90 0.00 0.00 155 R 7.55 4.66 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 156 E 8.57 4.25 0.00 2.07 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 2.29 0.00 157 E 8.42 4.50 0.00 2.07 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 0.00 2.18 2.27 0.00 *158 G 8.59 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.