NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3690 8.2649 123.5861 52.3706 19.9096 176.9367 3 T 3.9580 8.5484 118.9568 64.8224 68.9289 173.5212 4 L 4.4924 7.5776 123.7775 53.5174 41.5079 174.8679 5 R 4.8749 8.1806 119.0576 53.6538 32.8907 175.5585 6 S 5.0495 8.6056 113.5458 58.8351 64.2507 172.9019 7 F 4.9421 8.3398 114.8427 55.7336 41.8247 173.2234 8 V 4.1096 8.3729 119.8992 62.1957 31.0557 175.4057 9 L 4.0893 8.3768 131.1978 56.2774 42.5812 176.4798 10 V 4.0577 7.2911 118.0230 60.7898 32.7799 173.9146 11 D 4.9374 8.5802 128.3315 53.6071 40.1035 175.0559 12 N 4.7672 9.3686 125.9322 52.9094 39.4429 175.7689 13 G 3.6789 9.0943 103.3035 46.7349 0.0000 174.6382 14 G 4.2433 8.4256 113.3931 45.9607 0.0000 174.2361 15 T 3.6662 7.2596 108.7373 63.0872 68.9912 173.9529 16 G 4.0650 7.6108 113.4932 44.3048 0.0000 173.5395 17 N 4.5362 8.0046 116.3258 53.1439 39.8144 175.8638 18 V 3.9997 8.3621 123.4097 61.7307 32.9226 174.5987 19 T 4.8520 8.2462 124.8151 61.8882 70.9019 174.6321 20 V 4.5112 8.0442 123.3841 60.0135 34.5158 175.0455 21 V 4.9633 8.9257 116.6803 58.8033 35.1500 173.3575 22 P 4.3858 0.0000 0.0000 62.8965 31.3473 176.5858 23 V 4.4054 8.5797 120.7480 63.7712 34.5549 174.9506 24 S 4.6295 7.6442 112.7158 56.8978 66.7150 174.4959 25 N 4.9719 8.3247 114.2697 53.3310 39.6481 173.4756 26 A 4.0464 8.2014 119.4326 53.3257 18.8782 178.0005 27 N 4.3417 9.8657 117.1666 54.0206 36.4721 174.3120 28 G 3.7208 7.6809 101.7975 47.0788 0.0000 175.2489 29 V 4.5127 7.8017 120.4585 60.2426 33.1806 174.7460 30 A 3.9768 8.8412 130.6551 51.6921 19.7250 175.6474 31 E 5.2151 8.2526 122.1851 54.2538 33.0148 174.2601 32 W 5.2959 10.1255 127.0933 55.0018 32.3610 174.5627 33 L 5.3240 9.3279 126.1129 53.2930 45.1552 176.4844 34 S 4.6219 8.6130 120.1712 57.6674 65.0970 174.4145 35 N 4.6414 8.4184 118.0152 51.8688 36.8914 172.8213 36 N 4.9108 7.5594 118.4971 51.4332 43.4934 174.2805 37 S 4.3441 8.3643 113.3795 58.1777 63.5516 175.3632 38 R 4.1525 8.7923 121.8437 59.5711 30.0032 179.1207 39 S 4.1888 7.5349 111.9889 60.3771 63.1496 174.9211 40 Q 4.4202 8.2469 117.6248 55.2345 29.2239 175.3948 41 A 4.4057 7.2866 119.8965 51.9599 19.5484 177.2748 42 Y 4.3889 9.5674 118.3313 57.5891 39.6493 174.9610 43 R 5.3297 8.8440 122.4011 54.9946 34.4842 173.8284 44 V 5.2263 9.1611 124.2762 61.5933 35.3331 174.0177 45 T 6.0180 9.5914 116.7891 59.2937 72.4632 172.5502 46 A 5.9343 8.9389 123.1932 51.8936 22.9735 175.0633 47 S 5.0470 8.6962 112.9344 57.5139 66.6907 172.7039 48 Y 5.0408 8.7388 123.0668 55.8379 39.6989 174.4667 49 R 4.4950 8.3065 122.1695 53.8895 32.8877 175.3994 50 A 4.4023 8.0604 121.9286 51.2552 19.9787 177.0046 51 S 4.2932 8.6003 114.3182 57.7482 65.5569 175.6252 52 G 3.8927 8.6834 117.5029 45.1188 0.0000 173.4820 53 A 4.6997 7.8039 125.2589 51.8176 19.3885 177.3648 54 D 4.7374 7.4908 115.6876 54.1067 41.3009 174.4356 55 K 4.7300 7.5906 115.5673 57.0825 36.1244 174.2156 56 R 4.7287 8.5072 120.8845 54.5386 33.6787 174.9872 57 K 5.0114 8.5464 121.1174 55.2035 35.9695 174.3350 58 Y 5.2583 9.3561 124.9203 56.8147 40.7687 174.8504 59 T 5.0844 9.1350 119.5853 62.0300 72.0914 173.0080 60 I 5.3259 8.9602 127.2210 59.4482 41.1708 174.9507 61 K 5.1943 9.3549 124.3999 54.6457 36.6157 175.0614 62 L 5.3442 9.0495 124.8902 53.3642 45.9274 174.7661 63 E 4.9347 9.2569 124.8765 54.3924 32.9580 174.9801 64 V 4.4258 8.4583 124.3747 60.1709 34.3540 173.2430 65 P 4.7764 0.0000 0.0000 62.2931 32.5745 175.3746 66 K 4.2764 8.5100 122.8440 56.2930 32.7062 175.9344 67 I 4.3073 8.4733 127.0451 63.1017 38.6761 176.4884 68 V 3.8343 7.6085 111.8499 63.4898 31.6638 176.7417 69 T 3.7112 8.8619 120.2304 63.4983 66.8655 172.4534 70 Q 3.8607 8.0923 119.6311 56.0587 29.2105 176.3170 71 V 4.0011 7.9191 120.6831 60.8016 31.5547 175.3959 72 V 3.7309 8.1379 127.5911 64.4063 31.6919 175.7027 73 N 4.1775 9.5878 123.0274 53.6589 36.8252 174.6330 74 G 3.7654 7.7221 108.0291 44.7875 0.0000 174.2541 75 V 4.0110 7.8981 118.8639 60.7523 30.9500 173.0806 76 E 4.4545 8.1186 124.0993 54.1214 30.7663 175.8652 77 L 4.7860 8.2617 123.6783 52.5045 44.0607 174.4585 78 P 4.7156 0.0000 0.0000 61.7199 32.7323 177.6530 79 V 3.7669 8.6323 121.7222 66.2833 31.2214 178.3433 80 S 4.4991 8.3557 112.3522 61.3782 62.4827 175.6457 81 A 4.3335 8.2625 122.9013 52.7248 19.0239 177.5265 82 W 4.8514 8.4624 117.3849 55.9888 30.4450 175.5892 83 K 4.9274 8.0637 118.6750 55.2935 34.7560 174.4095 84 A 4.9399 9.0473 127.8922 50.3822 21.7298 175.0468 85 Y 5.2636 8.7658 117.6224 56.2982 41.5467 175.0627 86 A 4.8655 8.9527 122.5634 50.6605 23.1868 175.3527 87 S 5.0992 8.7170 116.0006 56.8505 66.8350 173.5991 88 I 4.6854 9.1671 124.7849 59.5536 40.6667 174.0012 89 D 5.3747 8.9309 126.1571 52.3856 43.4581 175.0129 90 L 4.8439 9.1034 125.8256 53.4701 44.9777 174.9539 91 T 5.0877 8.7182 122.3487 61.8681 71.1988 173.4756 92 I 4.6693 8.8323 127.5003 58.4557 40.5877 173.6781 93 P 4.6489 0.0000 0.0000 62.4767 31.6192 177.4519 94 I 3.5866 7.6174 114.0008 63.9581 37.2989 177.2691 95 F 4.4470 7.1893 117.3148 58.5893 39.1116 175.4381 96 A 4.2195 7.8842 124.7431 52.1641 18.7429 176.7995 97 A 4.8094 8.8060 125.2707 50.4133 21.6173 177.6320 98 T 3.8078 8.1113 109.1692 65.3738 68.5857 175.5871 99 D 4.3544 8.2248 122.4426 55.7575 39.1773 178.4633 100 D 4.3570 8.4424 120.3704 57.3064 40.9323 178.6604 101 V 3.6492 7.8582 118.4623 66.3798 31.4991 177.9736 102 T 4.0524 8.2861 109.6860 64.5552 68.3654 176.7150 103 V 3.4935 7.5003 121.1446 65.9053 31.6168 177.6637 104 I 3.7151 7.6975 119.6284 64.7692 37.1346 177.6534 105 S 4.0200 8.4645 113.7290 61.8204 62.1149 176.4901 106 K 3.9573 8.4572 121.0300 59.4425 31.8177 179.3855 107 S 4.0860 8.8235 116.0783 61.6668 62.8828 176.6248 108 L 3.9848 8.0558 121.1705 58.0232 41.2312 179.3587 109 A 4.1645 7.7337 118.8216 55.2373 18.5529 179.7143 110 G 3.6243 8.6519 104.2597 47.8099 0.0000 175.2898 111 L 3.7566 7.9636 122.4828 57.7839 42.0791 178.4998 112 F 4.5999 7.6188 113.1712 56.2234 39.9472 176.1130 113 K 3.9871 7.5160 121.3839 56.3151 32.6025 176.0556 114 V 3.9044 8.1619 124.9263 64.1789 31.9353 176.1603 115 G 4.0456 9.0983 115.2869 45.4027 0.0000 173.7145 116 N 4.8174 7.8989 117.1029 51.1902 41.2486 173.9315 117 P 4.1792 0.0000 0.0000 66.5196 31.2162 178.2429 118 I 3.9454 7.9144 119.5823 63.7077 37.0997 177.9209 119 A 4.0660 8.0254 120.6717 55.2315 18.3960 178.7765 120 E 3.8062 8.7039 117.7664 59.5229 29.6632 178.6857 121 A 3.8400 8.5826 120.8366 55.3482 18.3769 179.3173 122 I 3.6384 7.8220 118.2217 64.8114 37.1361 178.6321 123 S 4.4126 7.9811 112.4472 59.8846 62.9796 175.1794 124 S 4.6198 7.4383 116.2545 57.3921 63.1465 173.8219 125 Q 3.4680 7.6728 118.9397 57.2650 26.6081 173.6425 126 S 4.6605 7.8446 114.2068 57.3365 65.0562 173.5862 127 G 4.1571 8.1486 110.1334 44.4416 0.0000 172.1336 128 F 4.8332 8.2539 118.9224 55.8743 41.3801 174.2324 129 Y 4.6206 7.6222 120.0079 56.5573 39.9295 173.8443 130 A 4.1810 8.7797 122.7736 52.4537 19.1294 177.3526 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 A 8.26 4.37 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.55 3.96 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 1.25 0.00 0.00 4 L 7.58 4.49 0.00 1.53 1.57 0.22 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.18 4.87 0.00 2.02 1.93 0.00 3.17 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 6 S 8.61 5.05 0.00 3.99 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.34 4.94 0.00 3.05 3.07 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 8 V 8.37 4.11 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 0.79 0.00 0.00 0.91 0.00 0.00 9 L 8.38 4.09 0.00 1.12 1.33 0.97 0.89 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 10 V 7.29 4.06 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.79 0.00 0.00 11 D 8.58 4.94 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 N 9.37 4.77 0.00 2.78 2.79 0.00 0.00 6.97 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 9.09 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.43 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.26 3.67 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 16 G 7.61 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 17 N 8.00 4.54 0.00 2.55 2.70 0.00 0.00 6.99 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.36 4.00 1.60 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 0.12 0.00 0.00 0.58 0.00 0.00 19 T 8.25 4.85 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 20 V 8.04 4.51 1.61 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 -0.01 0.00 0.00 0.93 0.00 0.00 21 V 8.93 4.96 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 0.81 0.00 0.00 1.02 0.00 0.00 22 P 0.00 4.39 0.00 1.82 1.64 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 23 V 8.58 4.41 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 0.78 0.00 0.00 0.98 0.00 0.00 24 S 7.64 4.63 0.00 3.84 3.87 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 0.00 0.00 0.00 25 N 8.32 4.97 0.00 2.67 2.66 0.00 0.00 6.75 8.15 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 26 A 8.20 4.05 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 27 N 9.87 4.34 0.00 2.81 2.85 0.00 0.00 7.01 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.68 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 29 V 7.80 4.51 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.03 0.00 0.00 30 A 8.84 3.98 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 31 E 8.25 5.22 0.00 1.95 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 0.00 2.22 2.34 0.00 32 W 10.13 5.30 0.00 3.32 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 33 L 9.33 5.32 0.00 1.69 1.49 0.95 1.13 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 34 S 8.61 4.62 0.00 3.93 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 35 N 8.42 4.64 0.00 2.69 2.77 0.00 0.00 6.68 7.79 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 36 N 7.56 4.91 0.00 2.73 2.70 0.00 0.00 7.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.36 4.34 0.00 3.98 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 38 R 8.79 4.15 0.00 1.90 2.07 0.00 3.14 0.00 0.00 3.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 39 S 7.53 4.19 0.00 4.15 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 40 Q 8.25 4.42 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 41 A 7.29 4.41 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 42 Y 9.57 4.39 0.00 2.85 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.84 5.33 0.00 1.90 1.73 0.00 3.09 0.00 0.00 3.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 44 V 9.16 5.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 45 T 9.59 6.02 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 46 A 8.94 5.93 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.70 5.05 0.00 3.92 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 48 Y 8.74 5.04 0.00 2.70 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 49 R 8.31 4.50 0.00 1.83 1.94 0.00 2.78 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 50 A 8.06 4.40 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 51 S 8.60 4.29 0.00 3.72 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 52 G 8.68 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 53 A 7.80 4.70 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 54 D 7.49 4.74 0.00 2.56 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 55 K 7.59 4.73 0.00 1.68 1.83 0.00 1.24 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.45 7.81 56 R 8.51 4.73 0.00 1.60 1.05 0.00 2.99 0.00 0.00 2.94 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 57 K 8.55 5.01 0.00 1.69 1.49 0.00 1.59 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.56 7.81 58 Y 9.36 5.26 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 9.14 5.08 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 60 I 8.96 5.33 1.91 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 1.33 0.80 0.97 0.00 0.00 61 K 9.35 5.19 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.43 7.81 62 L 9.05 5.34 0.00 1.70 1.43 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.26 4.93 0.00 1.82 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.22 0.00 64 V 8.46 4.43 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 0.86 0.00 0.00 0.89 0.00 0.00 65 P 0.00 4.78 0.00 1.96 1.91 0.00 2.44 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.27 0.00 66 K 8.51 4.28 0.00 1.82 2.04 0.00 1.43 0.00 0.00 0.91 0.00 0.00 2.40 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.56 1.40 7.81 67 I 8.47 4.31 1.93 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 1.46 0.67 0.97 0.00 0.00 68 V 7.61 3.83 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 0.73 0.00 0.00 0.95 0.00 0.00 69 T 8.86 3.71 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 70 Q 8.09 3.86 0.00 1.95 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.23 0.00 71 V 7.92 4.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 72 V 8.14 3.73 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 0.83 0.00 0.00 0.91 0.00 0.00 73 N 9.59 4.18 0.00 2.83 2.90 0.00 0.00 7.00 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.72 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.90 4.01 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 0.84 0.00 0.00 0.89 0.00 0.00 76 E 8.12 4.45 0.00 1.16 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 1.99 1.96 0.00 77 L 8.26 4.79 0.00 1.67 1.64 0.95 1.10 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 78 P 0.00 4.72 0.00 2.25 2.01 0.00 3.74 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 2.13 2.12 0.00 79 V 8.63 3.77 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 1.06 0.00 0.00 0.99 0.00 0.00 80 S 8.36 4.50 0.00 4.09 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 81 A 8.26 4.33 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 82 W 8.46 4.85 0.00 3.24 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 83 K 8.06 4.93 0.00 1.75 1.54 0.00 1.67 0.00 0.00 1.51 0.00 0.00 2.72 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.73 1.31 7.81 84 A 9.05 4.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 8.77 5.26 0.00 2.78 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.95 4.87 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 87 S 8.72 5.10 0.00 3.75 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 9.17 4.69 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 1.19 0.64 0.97 0.00 0.00 89 D 8.93 5.37 0.00 2.55 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 90 L 9.10 4.84 0.00 1.82 1.70 1.00 0.68 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 91 T 8.72 5.09 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 92 I 8.83 4.67 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.95 1.00 0.00 0.00 93 P 0.00 4.65 0.00 2.25 2.22 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 94 I 7.62 3.59 1.62 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 -0.36 0.73 0.00 0.00 95 F 7.19 4.45 0.00 3.13 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 96 A 7.88 4.22 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 97 A 8.81 4.81 1.28 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 98 T 8.11 3.81 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 99 D 8.22 4.35 0.00 2.89 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 0.00 100 D 8.44 4.36 0.00 2.92 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.86 3.65 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 1.01 0.00 0.00 1.00 0.00 0.00 102 T 8.29 4.05 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 103 V 7.50 3.49 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.02 0.00 0.00 104 I 7.70 3.72 2.09 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 1.43 0.67 0.93 0.00 0.00 105 S 8.46 4.02 0.00 3.83 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 0.00 106 K 8.46 3.96 0.00 1.94 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 S 8.82 4.09 0.00 3.94 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 0.00 108 L 8.06 3.98 0.00 1.87 1.82 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.73 4.16 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 0.00 110 G 8.65 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 0.00 111 L 7.96 3.76 0.00 1.47 1.62 0.66 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.62 4.60 0.00 3.15 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 0.00 113 K 7.52 3.99 0.00 1.99 1.83 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.41 7.81 114 V 8.16 3.90 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 0.85 0.00 0.00 0.96 0.00 0.00 115 G 9.10 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 0.00 116 N 7.90 4.82 0.00 2.96 2.71 0.00 0.00 6.54 7.60 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 0.00 117 P 0.00 4.18 0.00 2.34 2.36 0.00 3.70 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 2.09 0.00 118 I 7.91 3.95 1.93 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 1.32 0.56 0.92 0.00 0.00 119 A 8.03 4.07 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.70 3.81 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 121 A 8.58 3.84 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 I 7.82 3.64 2.11 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.97 0.95 0.00 0.00 123 S 7.98 4.41 0.00 4.06 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.44 4.62 0.00 4.06 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 0.00 125 Q 7.67 3.47 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 126 S 7.84 4.66 0.00 3.84 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 0.00 127 G 8.15 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.25 4.83 0.00 3.08 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 0.00 129 Y 7.62 4.62 0.00 3.10 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 0.00 130 A 8.78 4.18 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