NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 3.9746 8.1933 115.1754 57.4181 63.4014 174.5995 2 W 4.3687 8.1480 127.1963 59.0307 28.9297 177.0093 3 Q 4.0695 8.9744 120.3388 59.6826 28.8981 178.0000 4 T 3.7906 7.7622 116.0148 66.8660 68.4817 175.5641 5 Y 4.4492 7.1372 118.3396 61.4373 37.9946 179.0635 6 V 3.6811 7.6914 117.8909 66.2853 31.7038 177.7380 7 D 4.3465 8.5557 118.6990 57.7411 40.5982 178.9785 8 T 3.9638 7.8633 114.7316 66.4260 68.8966 176.1230 9 N 4.5644 7.8822 115.4786 54.4481 38.6571 174.8010 10 L 4.5232 7.1825 116.0467 56.2084 44.7359 178.6870 11 V 3.8276 8.0387 117.1922 65.6792 31.8642 179.0381 12 G 3.8523 8.3586 107.8206 48.3554 0.0000 174.2865 13 T 4.0198 7.5945 109.0343 61.9892 69.3351 176.1283 14 G 3.8226 8.2724 109.2662 45.9035 0.0000 173.8920 15 A 4.4286 7.7588 121.7468 52.1070 19.4165 177.7920 16 V 4.6067 7.1848 114.9707 61.4424 34.9310 175.5387 17 T 4.1833 8.7955 123.6075 65.6935 69.3173 175.4301 18 Q 4.5707 7.6529 118.5526 53.9550 33.0313 174.1864 19 A 5.2578 9.0544 123.4964 50.5057 23.2419 174.7744 20 A 5.2874 9.2949 120.8064 50.4485 23.7030 175.2559 21 I 4.8273 8.9432 119.6726 59.7138 40.4380 175.3370 22 L 4.4941 9.1410 127.9773 52.6781 45.0363 176.0016 23 G 3.6716 7.8001 107.5798 44.7109 0.0000 175.2343 24 L 4.2093 8.4639 120.4314 56.3079 41.7897 177.7779 25 D 4.5071 8.0284 117.0529 53.2543 39.9998 177.3243 26 G 3.8907 8.5383 109.7754 45.5492 0.0000 173.0222 27 N 4.7017 7.9124 117.9213 52.5017 39.5304 174.9289 28 T 4.3037 8.3026 118.9152 63.5639 69.4091 174.3343 29 W 4.9142 9.3423 125.8325 58.4974 30.6434 176.6198 30 A 4.7757 7.6876 118.1210 51.3544 21.9033 175.2642 31 T 5.3135 8.4103 114.2022 60.1520 71.2628 173.5358 32 S 4.5061 9.2959 121.5391 57.6568 64.5397 173.4453 33 A 4.0389 8.7446 124.9576 54.2509 18.2737 178.1792 34 G 4.0050 9.0044 110.8629 45.3851 0.0000 172.9694 35 F 4.7215 8.6200 122.5920 56.9197 39.7728 174.6935 36 A 4.1757 8.0442 129.9282 50.2050 20.4304 174.6496 37 V 4.0844 7.7211 122.8657 62.3179 32.1714 176.6797 38 T 4.2451 8.0948 118.1303 60.3359 70.8528 173.4382 39 P 4.4268 0.0000 0.0000 65.8336 31.4678 178.3686 40 A 4.3322 8.0676 118.6635 55.7241 18.0898 179.5893 41 Q 4.0980 7.8759 116.2942 58.9053 28.7399 179.2976 42 G 3.7887 9.1131 109.5204 47.5929 0.0000 175.9552 43 T 3.9569 8.9983 113.7203 64.5705 68.7003 176.8033 44 T 3.8435 7.8364 118.3382 66.2334 68.2256 176.1919 45 L 3.6445 7.4540 121.0620 58.0291 42.3840 178.2468 46 A 4.4285 8.0283 120.6968 55.5535 18.2364 179.4956 47 G 3.7691 8.0930 103.4695 48.3407 0.0000 175.5878 48 A 4.6707 7.4880 122.8497 54.0774 18.3338 179.3960 49 F 4.1496 8.0611 116.4410 60.7253 38.9293 177.2168 50 N 4.7203 8.0320 115.2176 54.2318 38.9881 174.6003 51 N 4.7633 8.4907 121.3469 51.9472 41.0725 173.8681 52 A 4.4002 8.3637 128.8687 52.6169 18.7607 178.7014 53 D 4.2843 8.0983 119.6670 59.4581 40.8508 177.8709 54 A 3.7869 8.1692 118.3671 56.2997 18.2411 179.0284 55 I 3.8427 7.7377 115.1402 64.3290 37.3442 178.4943 56 R 3.8728 7.7890 117.9022 59.1874 29.9761 177.8302 57 A 4.4312 7.6896 118.5768 53.6103 19.3039 178.6848 58 G 3.9613 8.1786 101.6198 44.2723 0.0000 174.8024 59 G 4.0392 8.8579 110.0970 44.7906 0.0000 172.3218 60 F 4.9697 8.2426 111.8495 55.4214 40.9768 172.8093 61 D 5.3641 8.7065 121.0131 52.5940 42.4801 176.1813 62 L 4.5542 8.7857 123.2635 54.0299 45.0607 176.6229 63 A 3.6808 8.6741 126.3895 52.0516 16.1452 177.1655 64 G 3.9483 8.1715 107.7690 44.8095 0.0000 172.2473 65 V 4.0084 7.9437 120.7124 61.1055 32.9605 173.4972 66 H 5.1684 8.4292 127.1454 55.2483 30.6283 173.5848 67 Y 4.6602 8.5437 123.9852 56.5461 40.6815 175.1058 68 V 4.6349 8.3161 114.8626 59.9748 34.4219 175.5884 69 T 4.7063 8.6070 121.2538 64.0789 68.2610 174.3658 70 L 4.3914 9.3818 128.0280 56.9223 42.8225 177.7683 71 R 4.6522 7.8502 117.7196 54.5821 33.7634 173.9990 72 A 4.7955 8.3941 128.6357 50.9619 21.7470 174.5760 73 D 4.6621 8.0472 123.4925 52.7837 41.9269 174.6818 74 D 4.8075 8.7981 116.9705 56.6199 41.5762 176.8389 75 R 4.4592 8.3486 118.5139 56.7217 33.1255 175.7430 76 S 5.4474 9.3154 115.0222 56.7150 66.9810 173.3286 77 I 4.6351 8.8959 125.2138 59.7391 39.9071 173.9983 78 Y 5.5185 9.2756 125.6713 56.2640 40.5201 175.1982 79 G 4.5325 9.4440 110.9241 44.3736 0.0000 171.8405 80 K 5.1528 9.1488 122.9405 54.5485 36.3258 175.1945 81 K 4.5404 9.1614 128.2672 53.9758 34.1783 177.3777 82 G 3.8469 8.6775 119.6951 47.0820 0.0000 172.9211 83 S 4.5206 8.7057 121.4792 58.6050 62.8193 173.0481 84 S 4.4700 7.8488 118.0449 56.7915 66.3135 172.9872 85 G 3.9458 7.0831 106.0452 46.8509 0.0000 172.4410 86 V 4.9376 7.9818 118.2978 60.1509 35.1866 174.0330 87 I 4.8061 8.7967 124.3661 59.7872 39.8374 174.4223 88 T 5.2206 9.1287 117.9625 59.8379 71.6389 173.3992 89 V 4.8900 8.8571 124.8645 60.9540 34.5751 174.0005 90 K 4.1890 8.7127 130.9211 56.0286 32.5885 176.6519 91 T 4.5725 8.3674 119.6730 60.4277 71.2964 174.0898 92 S 4.2344 8.8183 114.5426 61.4146 63.1331 174.9384 93 K 4.5260 8.1600 116.1451 55.4470 33.5291 174.8866 94 A 4.3088 7.6732 120.4760 50.6126 23.5367 174.9768 95 I 4.6736 8.4903 119.5475 59.5629 40.7984 175.0768 96 L 4.8102 8.6812 127.1617 53.4919 43.7245 175.7634 97 V 4.6522 8.9042 123.4185 61.1293 34.5696 174.4205 98 G 4.3080 9.2298 116.1085 44.3302 0.0000 171.4154 99 V 4.4506 8.6053 128.3840 61.9408 32.6608 174.4967 100 Y 5.2457 8.7701 125.1639 55.2111 41.9179 173.9082 101 N 5.0061 8.3635 116.9924 50.0074 40.6137 175.0413 102 E 4.3088 8.8372 116.7623 57.9139 29.4322 178.0720 103 K 4.4152 8.1602 117.3552 56.1969 32.6017 176.3347 104 I 4.5440 7.5921 120.2401 58.9869 40.0624 175.8954 105 Q 4.1001 8.4040 123.3835 55.0532 29.6279 175.6290 106 P 3.3805 0.0000 0.0000 65.1834 31.4813 178.7667 107 G 3.6203 7.9187 104.0122 48.2800 0.0000 175.6957 108 T 3.8390 7.5830 117.3855 66.0800 68.6056 176.6047 109 A 4.0301 7.8619 123.6254 54.3889 18.3226 179.5686 110 A 3.6539 7.6133 119.1357 55.3206 18.5462 179.3716 111 N 4.2371 7.9628 115.5423 56.7625 39.1060 177.2907 112 V 3.5424 7.9188 119.7262 65.8850 31.6810 178.2730 113 V 3.5833 7.6777 117.8969 66.0863 31.4215 177.6867 114 E 4.0373 8.3006 118.3579 59.6396 29.3260 179.6882 115 K 4.0781 8.0813 118.2810 59.2521 32.1178 179.2717 116 L 4.0420 8.0053 120.2013 57.6435 41.8715 178.9510 117 A 3.9721 8.1527 121.0030 55.2512 18.2701 179.0142 118 D 4.3621 8.0560 117.4600 58.0435 40.6367 178.8247 119 Y 4.0552 8.1559 119.6780 60.6316 38.8004 177.9484 120 L 4.0489 8.1751 120.1366 57.6007 41.3407 179.2837 121 I 3.7852 8.2829 120.4183 64.5048 36.9542 178.5690 122 G 3.6789 7.5079 107.2476 48.2554 0.0000 174.0675 123 Q 3.9340 7.0204 116.5499 55.8311 29.2356 176.5778 124 G 3.8181 8.9270 107.0161 45.0406 0.0000 173.8533 125 F 4.8635 8.1429 124.4450 57.4958 39.2263 175.5566 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 S 8.19 3.97 0.00 3.62 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 2 W 8.15 4.37 0.00 3.62 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 3 Q 8.97 4.07 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.76 0.00 4 T 7.76 3.79 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 1.09 0.00 0.00 5 Y 7.14 4.45 0.00 3.33 3.10 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 6 V 7.69 3.68 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.15 0.00 0.00 7 D 8.56 4.35 0.00 2.77 2.71 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 8 T 7.86 3.96 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 1.20 0.00 0.00 9 N 7.88 4.56 0.00 3.01 2.92 0.00 0.00 6.97 8.24 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 10 L 7.18 4.52 0.00 1.94 1.60 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.04 3.83 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.93 0.00 0.00 12 G 8.36 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.59 4.02 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 1.31 0.00 0.00 14 G 8.27 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.76 4.43 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 16 V 7.18 4.61 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 1.03 0.00 0.00 0.93 0.00 0.00 17 T 8.80 4.18 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 1.16 0.00 0.00 18 Q 7.65 4.57 0.00 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.22 2.15 0.00 19 A 9.05 5.26 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 20 A 9.29 5.29 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 21 I 8.94 4.83 2.03 0.00 0.00 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 1.30 1.10 0.70 0.00 0.00 22 L 9.14 4.49 0.00 1.24 1.20 0.84 0.73 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 23 G 7.80 3.67 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 0.00 0.00 0.00 24 L 8.46 4.21 0.00 1.64 1.71 0.92 0.89 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 25 D 8.03 4.51 0.00 2.80 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 26 G 8.54 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 27 N 7.91 4.70 0.00 2.80 2.80 0.00 0.00 6.99 7.56 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 28 T 8.30 4.30 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 1.29 0.00 0.00 29 W 9.34 4.91 0.00 2.86 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 30 A 7.69 4.78 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 31 T 8.41 5.31 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 32 S 9.30 4.51 0.00 4.00 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 33 A 8.74 4.04 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 34 G 9.00 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 35 F 8.62 4.72 0.00 2.98 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.04 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.72 4.08 1.89 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 0.81 0.00 0.00 0.62 0.00 0.00 38 T 8.09 4.25 4.22 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 1.17 0.00 0.00 39 P 0.00 4.43 0.00 2.17 2.15 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 40 A 8.07 4.33 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 41 Q 7.88 4.10 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.62 2.39 0.00 42 G 9.11 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 0.00 0.00 0.00 43 T 9.00 3.96 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 1.34 0.00 0.00 44 T 7.84 3.84 4.43 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 1.22 0.00 0.00 45 L 7.45 3.64 0.00 1.56 1.87 0.54 1.10 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 46 A 8.03 4.43 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 47 G 8.09 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 48 A 7.49 4.67 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 49 F 8.06 4.15 0.00 3.16 3.03 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 50 N 8.03 4.72 0.00 2.88 2.86 0.00 0.00 6.59 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 51 N 8.49 4.76 0.00 2.71 2.62 0.00 0.00 7.20 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 52 A 8.36 4.40 1.21 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 0.00 0.00 53 D 8.10 4.28 0.00 2.80 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 54 A 8.17 3.79 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 55 I 7.74 3.84 1.73 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 1.26 0.53 0.66 0.00 0.00 56 R 7.79 3.87 0.00 2.06 1.93 0.00 3.28 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 57 A 7.69 4.43 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 58 G 8.18 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 0.00 0.00 0.00 59 G 8.86 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 0.00 0.00 0.00 60 F 8.24 4.97 0.00 3.13 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 61 D 8.71 5.36 0.00 2.71 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 62 L 8.79 4.55 0.00 1.87 1.78 1.02 0.99 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 63 A 8.67 3.68 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 64 G 8.17 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 V 7.94 4.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.87 0.00 0.00 66 H 8.43 5.17 0.00 3.14 3.07 0.00 5.95 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.54 4.66 0.00 1.83 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.32 4.63 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 0.74 0.00 0.00 0.98 0.00 0.00 69 T 8.61 4.71 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 1.22 0.00 0.00 70 L 9.38 4.39 0.00 1.83 1.85 1.10 0.94 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 71 R 7.85 4.65 0.00 1.72 1.56 0.00 2.92 0.00 0.00 2.83 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.37 0.00 72 A 8.39 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.05 4.66 0.00 2.66 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 74 D 8.80 4.81 0.00 2.71 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 75 R 8.35 4.46 0.00 1.84 1.87 0.00 3.12 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 76 S 9.32 5.45 0.00 3.68 3.36 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 77 I 8.90 4.64 1.35 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 0.77 0.16 0.29 0.00 0.00 78 Y 9.28 5.52 0.00 2.79 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 79 G 9.44 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 9.15 5.15 0.00 1.91 1.68 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.53 7.81 81 K 9.16 4.54 0.00 1.24 1.30 0.00 1.64 0.00 0.00 1.52 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.12 1.12 7.81 82 G 8.68 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 8.71 4.52 0.00 3.91 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 84 S 7.85 4.47 0.00 3.79 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 85 G 7.08 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.98 4.94 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 0.21 0.00 0.00 0.84 0.00 0.00 87 I 8.80 4.81 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.74 0.74 0.00 0.00 88 T 9.13 5.22 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 1.32 0.00 0.00 89 V 8.86 4.89 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 1.01 0.00 0.00 1.15 0.00 0.00 90 K 8.71 4.19 0.00 0.79 0.74 0.00 1.30 0.00 0.00 1.56 0.00 0.00 2.73 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.10 0.95 7.81 91 T 8.37 4.57 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 1.25 0.00 0.00 92 S 8.82 4.23 0.00 4.00 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 93 K 8.16 4.53 0.00 2.16 2.13 0.00 2.05 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.44 7.81 94 A 7.67 4.31 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.49 4.67 1.75 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 0.91 0.79 1.05 0.00 0.00 96 L 8.68 4.81 0.00 1.62 1.61 0.98 0.45 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 97 V 8.90 4.65 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.03 0.00 0.00 98 G 9.23 4.31 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 0.00 99 V 8.61 4.45 1.77 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 0.91 0.00 0.00 0.65 0.00 0.00 100 Y 8.77 5.25 0.00 2.96 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 0.00 101 N 8.36 5.01 0.00 2.83 2.95 0.00 0.00 6.74 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 0.00 102 E 8.84 4.31 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 2.32 2.37 0.00 103 K 8.16 4.42 0.00 2.00 1.85 0.00 1.53 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.45 7.81 104 I 7.59 4.54 2.11 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 0.64 0.85 0.00 0.00 105 Q 8.40 4.10 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 106 P 0.00 3.38 0.00 1.99 1.79 0.00 3.52 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 107 G 7.92 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 0.00 108 T 7.58 3.84 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 1.16 0.00 0.00 109 A 7.86 4.03 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 0.00 110 A 7.61 3.65 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 0.00 111 N 7.96 4.24 0.00 2.94 2.80 0.00 0.00 6.93 7.72 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 0.00 112 V 7.92 3.54 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 0.92 0.00 0.00 0.95 0.00 0.00 113 V 7.68 3.58 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 1.01 0.00 0.00 0.97 0.00 0.00 114 E 8.30 4.04 0.00 2.13 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 2.62 2.62 0.00 115 K 8.08 4.08 0.00 2.02 1.87 0.00 1.58 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.51 7.81 116 L 8.01 4.04 0.00 1.95 1.76 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.15 3.97 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 0.00 118 D 8.06 4.36 0.00 2.95 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 0.00 119 Y 8.16 4.06 0.00 3.06 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 0.00 120 L 8.18 4.05 0.00 2.00 1.93 0.81 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.28 3.79 2.12 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 1.46 1.00 0.89 0.00 0.00 122 G 7.51 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 0.00 123 Q 7.02 3.93 0.00 1.75 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.18 2.50 0.00 124 G 8.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.14 4.86 0.00 3.46 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00