NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4398 8.3349 115.2905 58.1286 63.5490 172.7563 4 R 4.6235 8.2711 124.6281 53.7347 33.8717 173.0466 5 R 4.6175 8.8392 119.7458 55.0215 34.0631 174.1335 6 M 4.2891 8.5996 124.2963 55.4228 32.8377 175.6874 7 L 4.6063 8.5705 123.8444 56.5951 43.5204 176.0113 8 H 5.6040 7.5665 109.8417 56.1500 31.5363 172.5183 9 T 4.6730 8.4408 114.7964 61.9017 71.4720 172.8767 10 M 5.1224 8.5795 125.2931 53.6497 34.4881 174.7482 11 I 4.3717 8.1127 118.3101 58.9581 41.2489 174.4250 12 R 4.7032 7.7875 122.1782 55.4470 30.9797 176.4165 13 V 4.7402 8.8978 116.1177 59.7493 35.2588 177.2891 14 G 4.0647 9.8941 113.3684 46.6711 0.0000 173.8575 15 D 4.5819 7.8979 119.1688 51.2620 43.6221 175.5492 16 L 3.9692 8.0543 129.2924 58.4621 42.2257 178.4271 17 D 4.3598 7.9952 118.3656 57.1882 40.9008 178.5189 18 R 3.8949 8.3385 119.4226 59.4732 30.0981 178.6018 19 S 4.2587 8.1345 112.7393 61.3937 62.3744 176.0595 20 I 3.8326 8.0533 122.6727 64.3639 36.8543 178.1491 21 K 3.8954 8.3963 120.6325 59.4703 31.9490 178.4755 22 F 3.9920 8.1831 120.4547 61.7276 39.3638 176.8566 23 Y 3.9201 8.2087 116.5319 60.8386 37.6066 178.5143 24 T 4.5827 8.1129 112.3764 64.3337 69.1042 177.0126 25 E 3.9700 8.1395 121.5173 58.1266 29.8533 178.5825 26 R 4.0168 7.7586 116.7156 57.4439 30.5263 177.2627 27 L 4.3541 7.5234 114.8125 53.9535 43.0375 177.2787 28 G 3.9479 8.0893 106.4020 46.0132 0.0000 173.5418 29 M 4.4298 8.0806 119.8214 54.6008 33.5820 175.2846 30 K 4.8785 8.7056 119.4419 54.8818 36.0162 175.5685 31 V 3.9842 8.3320 122.3122 63.5018 31.5711 175.2662 32 L 4.5286 9.1835 129.1993 56.3599 42.4235 176.8984 33 R 4.6268 7.5841 112.3261 55.5359 32.3356 173.1009 34 K 5.2877 8.6460 118.3494 54.8400 36.2141 176.6397 35 W 5.0562 9.1979 132.5481 56.8543 32.8646 172.0541 36 D 5.0127 8.8117 126.4390 52.8301 42.4919 176.2809 37 V 4.1757 8.4833 125.9502 60.1577 31.6087 173.9388 38 P 4.4260 0.0000 0.0000 64.1473 31.8725 178.8122 39 E 3.9545 8.1951 115.3800 58.6282 29.5130 177.1976 40 D 4.7056 7.7865 116.0001 53.0709 41.8034 175.7786 41 K 2.4800 7.4292 118.4008 56.4538 29.9717 174.3372 42 Y 5.3741 6.7575 113.8529 56.1810 42.2214 174.0300 43 T 5.1090 9.2898 116.2672 61.9610 72.7140 173.1164 44 L 5.2255 9.2276 125.9563 53.2053 44.8801 175.7189 45 V 4.9524 8.4627 121.3212 61.3761 35.3189 173.8021 46 F 5.2262 9.2709 126.3428 55.9102 41.3153 174.8414 47 L 5.1560 8.7419 122.7304 53.4361 46.1913 176.3851 48 G 3.7541 8.1710 106.7427 47.0298 0.0000 172.9640 49 Y 4.6977 8.7629 116.0675 58.4307 38.6198 175.2045 50 G 4.2759 7.6698 106.5933 44.4818 0.0000 170.9054 51 P 4.5060 0.0000 0.0000 61.9808 32.0855 177.2289 52 E 4.1700 8.7969 119.6292 59.9929 29.5962 178.6246 53 M 4.1778 8.1822 117.5298 57.5771 32.0216 176.9805 54 S 4.7070 8.3432 109.8898 57.8226 64.2450 173.4625 55 S 4.7778 7.6185 116.3153 57.2566 66.8047 172.1985 56 T 4.8055 8.3666 118.2114 62.6873 69.8913 174.6961 57 V 4.5824 8.6395 118.7432 59.4759 36.3514 173.5487 58 L 4.9562 8.8410 123.2132 53.5812 44.2455 174.6453 59 E 4.4729 9.1044 127.5237 54.2846 31.8333 174.1748 60 L 5.0246 8.6868 127.1697 53.2981 44.4403 175.4223 61 T 4.9062 8.5829 120.1702 61.9315 71.4077 172.3320 62 Y 5.2780 9.0118 128.5390 55.3503 40.8855 173.9148 63 N 5.0440 7.9052 123.3228 51.7621 40.3679 174.5568 64 Y 4.0633 8.7626 122.6541 59.8784 38.2585 177.7526 65 G 3.9022 9.1069 113.3067 45.3451 0.0000 173.2849 66 V 3.9679 7.8219 121.2760 61.5204 31.2349 176.1728 67 T 4.3040 8.1132 117.9957 62.7772 69.5760 174.2720 68 S 4.7593 6.8612 113.8458 57.9521 64.9940 173.5047 69 Y 4.6132 8.2914 121.1158 55.8517 41.4015 175.1561 70 K 4.5007 8.4019 121.0752 55.5095 34.9133 175.2188 71 H 4.8539 8.3552 117.4515 54.0392 30.6982 174.6900 72 D 4.7595 8.5326 123.2095 53.0114 40.9644 175.8246 73 E 4.5086 8.6505 115.7897 56.3854 29.2343 176.9303 74 A 4.3738 7.9383 121.9816 53.9640 20.0546 177.7422 75 Y 4.2389 8.1766 116.2754 57.6604 39.0680 175.4194 76 G 3.3754 7.2396 116.7038 45.4349 0.0000 173.5472 77 H 4.5977 6.6241 114.3737 54.5864 31.7213 173.3567 78 I 4.6598 7.9382 119.5851 59.7795 39.2890 174.7952 79 A 5.1935 8.6830 127.4257 50.2687 21.2316 175.7766 80 I 4.5081 8.7579 123.4648 59.2726 40.3505 175.1331 81 G 4.0977 8.6858 114.5636 45.8117 0.0000 173.0010 82 V 4.5409 8.7613 123.8890 61.2141 35.0821 176.0528 83 E 4.0072 8.8319 123.9365 58.6901 30.0303 177.1961 84 D 4.4964 7.5371 117.6548 51.7069 42.5352 175.2229 85 V 3.5167 8.1581 125.9402 65.4867 31.8410 177.1086 86 K 4.1215 7.9959 120.1573 58.9520 32.0896 178.1989 87 E 3.8967 8.4759 119.4752 59.1406 29.5749 178.4989 88 L 3.9052 8.0323 120.4784 58.2335 42.1196 179.1322 89 V 3.5928 8.4273 118.2719 65.8525 31.3766 177.8924 90 A 3.9848 7.9035 120.6739 54.9961 18.2310 179.1392 91 D 4.3140 8.1338 116.6634 57.5592 41.2787 178.3680 92 M 4.0629 8.2120 119.3349 58.4159 32.0096 178.5714 93 R 3.8894 8.1886 118.9329 59.4750 30.0194 178.3201 94 K 3.9513 8.0470 118.0892 59.1981 32.1451 177.1446 95 H 4.8029 7.8160 114.2867 55.4664 29.9300 174.7945 96 D 4.4523 7.8755 117.5165 55.2395 38.8931 173.9461 97 V 3.9434 7.6872 119.4727 61.9266 32.3442 174.1654 98 P 4.3832 0.0000 0.0000 62.9946 32.4172 175.0547 99 I 4.5232 8.3535 125.6523 60.0677 37.8146 175.0410 100 D 4.7009 9.4144 128.7329 57.0840 42.0226 175.9800 101 Y 4.9929 7.9018 117.2543 56.5139 42.4043 173.1284 102 E 4.8571 7.7370 125.7688 54.6846 33.5128 174.0868 103 D 4.4539 8.4372 126.7293 52.1873 41.3187 177.3230 104 E 4.0365 8.7483 120.3925 59.1346 29.8145 177.9225 105 S 4.2252 8.0461 111.1795 58.9722 63.4871 174.9330 106 G 3.9236 7.8955 108.2210 45.7641 0.0000 174.2321 107 F 4.5548 8.1819 123.5629 60.7977 40.6377 175.0736 108 M 5.0062 8.6390 116.6734 53.9399 35.9750 173.7834 109 A 5.2065 8.7596 125.3188 50.5989 23.7253 174.7408 110 F 5.3177 9.5760 118.0937 55.8804 42.2817 175.1532 111 V 5.1013 9.2488 116.2194 59.5577 36.0565 174.4711 112 V 4.7282 8.2346 122.3442 61.0615 33.3432 175.5225 113 D 3.3700 8.7081 127.8587 51.4022 40.3289 175.5520 114 P 4.1432 0.0000 0.0000 65.0499 31.2525 177.2862 115 D 4.6054 8.2621 115.6949 54.2392 41.2663 177.0352 116 G 3.7974 8.1457 108.0217 44.9677 0.0000 173.4849 117 Y 4.2928 8.1702 117.5102 57.8932 39.2597 174.2356 118 Y 5.0895 8.7686 119.2140 57.0819 40.4275 174.5320 119 I 5.0628 9.1757 124.0057 59.5919 40.8313 173.9580 120 E 4.1124 9.0622 128.2996 54.6658 31.2520 174.3944 121 L 4.9633 8.5761 127.6282 53.2064 43.8400 175.5372 122 L 4.7801 8.4257 123.2195 52.2725 45.8728 175.3856 123 N 4.6119 8.7553 122.0406 53.8857 39.3466 175.0267 124 E 3.9264 9.2306 128.7850 59.1737 29.7458 178.4094 125 K 3.8690 8.0550 118.9962 60.0701 32.3002 178.6326 126 T 3.9049 8.5725 116.0570 66.7649 68.3702 176.2853 127 M 4.2258 8.4052 120.0887 59.1488 32.2544 178.2899 128 M 4.1125 8.1655 118.7670 58.3178 32.1896 178.4877 129 E 3.9624 8.2456 118.8104 59.3489 29.6792 179.3983 130 K 3.8912 8.0998 119.2959 59.4059 32.2626 178.7286 131 A 4.0048 8.0813 121.0903 55.1257 18.2460 179.2795 132 E 3.8491 8.6302 118.0542 59.3272 29.6826 178.7012 133 A 3.9797 7.9091 120.7240 55.5078 18.4044 179.4264 134 D 4.2975 8.2729 117.2393 57.5888 40.7728 178.9191 135 M 4.2971 8.1336 120.6766 57.8224 31.4423 178.9412 136 K 4.2253 8.2433 120.1567 58.8159 31.9912 179.0499 137 E 3.9645 8.1762 118.5843 59.2757 29.7398 178.0941 138 Q 4.4258 8.3034 115.0230 55.0300 28.9640 175.9529 139 G 3.9124 7.4853 107.1944 46.9993 0.0000 174.9559 140 T 4.3226 8.1352 109.4149 61.4069 69.5158 174.6791 141 A 4.1798 7.5546 130.7957 52.6763 19.2824 175.6806 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 3 S 8.33 4.44 0.00 3.85 3.83 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 4 R 8.27 4.62 0.00 1.87 1.77 0.00 3.25 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 5 R 8.84 4.62 0.00 1.72 1.74 0.00 3.25 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 6 M 8.60 4.29 0.00 2.07 2.02 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 2.62 2.51 0.00 7 L 8.57 4.61 0.00 1.58 1.76 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 8 H 7.57 5.60 0.00 3.28 3.37 0.00 5.08 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.44 4.67 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 1.19 0.00 0.00 10 M 8.58 5.12 0.00 1.88 2.01 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 11 I 8.11 4.37 0.72 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.35 0.23 0.00 0.00 12 R 7.79 4.70 0.00 0.83 0.95 0.00 2.89 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.35 0.00 13 V 8.90 4.74 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 0.99 0.00 0.00 1.11 0.00 0.00 14 G 9.89 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 15 D 7.90 4.58 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.05 3.97 0.00 1.59 1.50 0.99 1.29 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 17 D 8.00 4.36 0.00 2.69 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 18 R 8.34 3.89 0.00 2.00 2.18 0.00 3.10 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 1.66 1.67 0.00 19 S 8.13 4.26 0.00 4.10 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 20 I 8.05 3.83 2.05 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 1.45 0.60 0.95 0.00 0.00 21 K 8.40 3.90 0.00 2.00 2.06 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.48 7.81 22 F 8.18 3.99 0.00 3.10 3.01 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 23 Y 8.21 3.92 0.00 3.15 2.98 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 24 T 8.11 4.58 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 1.30 0.00 0.00 25 E 8.14 3.97 0.00 2.06 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 2.34 0.00 26 R 7.76 4.02 0.00 0.97 1.51 0.00 3.26 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.00 27 L 7.52 4.35 0.00 1.66 1.80 1.01 0.95 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 28 G 8.09 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 29 M 8.08 4.43 0.00 1.83 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.17 0.00 30 K 8.71 4.88 0.00 1.78 1.90 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.34 7.81 31 V 8.33 3.98 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 0.83 0.00 0.00 0.96 0.00 0.00 32 L 9.18 4.53 0.00 1.71 1.70 0.98 0.91 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 33 R 7.58 4.63 0.00 1.83 1.95 0.00 2.72 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 34 K 8.65 5.29 0.00 1.69 1.82 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.72 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.46 7.81 35 W 9.20 5.06 0.00 3.54 3.01 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 36 D 8.81 5.01 0.00 2.80 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 37 V 8.48 4.18 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 0.80 0.00 0.00 0.14 0.00 0.00 38 P 0.00 4.43 0.00 2.29 2.28 0.00 3.94 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 2.17 2.30 0.00 39 E 8.20 3.95 0.00 2.06 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 2.26 2.31 0.00 40 D 7.79 4.71 0.00 2.83 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 41 K 7.43 2.48 0.00 1.70 1.60 0.00 1.78 0.00 0.00 1.47 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.22 1.44 7.81 42 Y 6.76 5.37 0.00 3.12 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 43 T 9.29 5.11 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 1.33 0.00 0.00 44 L 9.23 5.23 0.00 1.72 1.36 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.46 4.95 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 1.07 0.00 0.00 0.98 0.00 0.00 46 F 9.27 5.23 0.00 3.06 2.93 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 47 L 8.74 5.16 0.00 1.41 1.40 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.17 3.75 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 0.00 0.00 0.00 49 Y 8.76 4.70 0.00 3.04 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 50 G 7.67 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 0.00 0.00 0.00 0.00 51 P 0.00 4.51 0.00 2.22 2.18 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 52 E 8.80 4.17 0.00 1.89 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 2.28 2.30 0.00 53 M 8.18 4.18 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 54 S 8.34 4.71 0.00 3.91 3.92 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 55 S 7.62 4.78 0.00 3.99 3.80 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 56 T 8.37 4.81 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 1.27 0.00 0.00 57 V 8.64 4.58 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 0.90 0.00 0.00 1.11 0.00 0.00 58 L 8.84 4.96 0.00 1.51 1.43 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 59 E 9.10 4.47 0.00 1.55 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.47 0.00 60 L 8.69 5.02 0.00 1.48 1.49 0.93 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.58 4.91 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 1.13 0.00 0.00 62 Y 9.01 5.28 0.00 3.14 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 63 N 7.91 5.04 0.00 2.70 2.64 0.00 0.00 6.55 7.36 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 64 Y 8.76 4.06 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 65 G 9.11 3.90 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 0.00 0.00 0.00 66 V 7.82 3.97 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 0.47 0.00 0.00 0.85 0.00 0.00 67 T 8.11 4.30 4.26 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 1.24 0.00 0.00 68 S 6.86 4.76 0.00 3.75 3.60 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 69 Y 8.29 4.61 0.00 2.82 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.40 4.50 0.00 1.81 1.74 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.42 7.81 71 H 8.36 4.85 0.00 3.15 3.27 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.53 4.76 0.00 2.81 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 73 E 8.65 4.51 0.00 1.97 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 2.24 2.30 0.00 74 A 7.94 4.37 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 75 Y 8.18 4.24 0.00 2.95 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.24 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 0.00 0.00 0.00 77 H 6.62 4.60 0.00 3.38 3.42 0.00 5.51 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.94 4.66 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 1.27 0.81 1.03 0.00 0.00 79 A 8.68 5.19 1.25 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 0.00 0.00 0.00 80 I 8.76 4.51 1.94 0.00 0.00 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 1.38 0.85 0.99 0.00 0.00 81 G 8.69 4.10 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 0.00 0.00 0.00 82 V 8.76 4.54 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 1.02 0.00 0.00 0.91 0.00 0.00 83 E 8.83 4.01 0.00 1.96 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 2.26 2.24 0.00 84 D 7.54 4.50 0.00 2.63 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.16 3.52 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.89 0.00 0.00 86 K 8.00 4.12 0.00 1.85 1.91 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.34 7.81 87 E 8.48 3.90 0.00 2.34 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 0.00 2.30 2.45 0.00 88 L 8.03 3.91 0.00 1.83 1.81 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.43 3.59 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.93 0.00 0.00 90 A 7.90 3.98 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 91 D 8.13 4.31 0.00 2.84 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 92 M 8.21 4.06 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 93 R 8.19 3.89 0.00 1.92 2.19 0.00 3.11 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 94 K 8.05 3.95 0.00 1.94 2.02 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.45 7.81 95 H 7.82 4.80 0.00 3.15 3.33 0.00 6.06 0.00 0.00 0.00 0.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.88 4.45 0.00 2.88 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 97 V 7.69 3.94 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.18 0.00 0.00 98 P 0.00 4.38 0.00 2.11 1.98 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 99 I 8.35 4.52 1.92 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 1.38 0.86 0.96 0.00 0.00 100 D 9.41 4.70 0.00 2.99 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 0.00 101 Y 7.90 4.99 0.00 3.13 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 0.00 102 E 7.74 4.86 0.00 1.93 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 103 D 8.44 4.45 0.00 2.88 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 0.00 104 E 8.75 4.04 0.00 1.95 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 2.28 2.24 0.00 105 S 8.05 4.23 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 0.00 106 G 7.90 3.92 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 0.00 0.00 0.00 107 F 8.18 4.55 0.00 3.27 3.33 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 0.00 108 M 8.64 5.01 0.00 2.24 1.34 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.62 0.00 109 A 8.76 5.21 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 0.00 110 F 9.58 5.32 0.00 3.14 3.08 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 0.00 0.00 0.00 111 V 9.25 5.10 2.23 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 0.81 0.00 0.00 1.11 0.00 0.00 112 V 8.23 4.73 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 0.51 0.00 0.00 0.84 0.00 0.00 113 D 8.71 3.37 0.00 1.85 2.53 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 0.00 114 P 0.00 4.14 0.00 2.02 2.10 0.00 3.26 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.89 0.00 115 D 8.26 4.61 0.00 2.98 2.85 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 0.00 116 G 8.15 3.80 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 0.00 0.00 0.00 117 Y 8.17 4.29 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 8.77 5.09 0.00 3.14 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 0.00 119 I 9.18 5.06 2.08 0.00 0.00 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 1.42 1.13 1.10 0.00 0.00 120 E 9.06 4.11 0.00 1.38 1.53 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 1.78 1.47 0.00 121 L 8.58 4.96 0.00 1.47 1.47 0.91 0.36 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 0.00 122 L 8.43 4.78 0.00 1.39 1.19 0.88 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 123 N 8.76 4.61 0.00 2.80 2.91 0.00 0.00 6.69 8.23 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 0.00 124 E 9.23 3.93 0.00 2.01 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 2.31 2.32 0.00 125 K 8.05 3.87 0.00 1.87 2.00 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.55 7.81 126 T 8.57 3.90 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 1.05 0.00 0.00 127 M 8.41 4.23 0.00 2.33 2.28 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 2.68 2.69 0.00 128 M 8.17 4.11 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.94 0.00 129 E 8.25 3.96 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 130 K 8.10 3.89 0.00 1.89 2.07 0.00 1.53 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.58 7.81 131 A 8.08 4.00 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 0.00 132 E 8.63 3.85 0.00 2.11 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 2.31 2.33 0.00 133 A 7.91 3.98 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 0.00 134 D 8.27 4.30 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 M 8.13 4.30 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.45 0.00 136 K 8.24 4.23 0.00 1.96 1.86 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.44 7.81 137 E 8.18 3.96 0.00 2.08 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 2.32 2.35 0.00 138 Q 8.30 4.43 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.43 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 139 G 7.49 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 0.00 0.00 0.00 140 T 8.14 4.32 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 0.00 141 A 7.55 4.18 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