NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5055 8.2893 120.3270 54.9350 33.8447 175.0679 2 T 4.5582 7.3605 108.6314 59.3322 73.1955 171.2251 3 I 3.5736 9.4298 121.6051 64.8461 37.2747 178.9762 4 D 4.3896 8.0862 118.6795 58.1066 40.9031 179.1238 5 E 4.6934 7.6293 119.6346 59.0323 29.4411 179.1049 6 I 3.6568 8.0813 119.8201 64.8101 37.1733 178.3270 7 I 3.6726 8.0022 120.3449 64.4677 36.8962 178.0379 8 E 3.9289 8.3658 119.3678 59.4947 29.2513 179.4455 9 A 3.9656 8.2078 120.5508 55.2846 18.2896 179.5974 10 I 3.6328 7.7410 117.0928 64.9723 37.2670 177.8805 11 E 3.9944 8.2410 118.0215 59.8025 29.3630 179.1934 12 K 4.2789 8.4359 118.7196 58.4996 32.4707 176.3222 13 L 4.7311 8.0377 120.2213 54.3219 41.4245 177.7076 14 T 3.9622 8.6652 114.7430 61.8545 70.3596 174.5057 15 V 3.4956 8.4720 121.1482 66.4543 31.3316 178.6066 16 S 4.0986 7.9913 113.3050 61.6005 63.0062 176.0711 17 E 3.9497 8.1080 122.2761 58.9131 29.1097 179.0988 18 L 3.9486 8.2302 118.8263 57.6814 41.6636 179.0254 19 A 3.9987 8.3392 120.7638 55.6112 18.3153 179.5645 20 E 3.9095 8.4627 116.7480 59.6475 29.5157 179.7582 21 L 4.0515 8.2475 119.2495 57.4965 41.5444 179.6203 22 V 3.5775 8.0744 118.5609 66.2102 31.4192 177.6584 23 K 3.9328 8.2523 118.0328 60.6777 31.7570 178.5420 24 K 3.7839 8.4950 117.4600 60.1102 32.2581 178.4729 25 L 4.1986 8.6855 119.0761 58.3346 41.8827 179.7189 26 E 4.0579 8.4690 118.2743 59.7811 29.3440 179.0728 27 D 3.9391 8.1198 117.2207 56.8311 40.9726 178.5716 28 K 4.1032 8.4001 118.2760 57.2657 32.6051 177.2917 29 F 4.8150 7.6075 115.9365 56.1925 40.5289 173.5372 30 G 4.0345 9.1449 112.9233 45.5450 0.0000 175.8079 31 V 4.1069 8.1409 118.0249 62.3347 30.4404 176.8533 32 T 4.6929 8.4802 108.5082 62.4423 74.5886 174.7303 33 A 3.9860 8.0532 126.7073 53.7718 18.7471 177.4569 34 A 4.3276 8.0676 118.2838 50.8652 19.5997 176.9015 35 A 4.7912 7.9155 129.1726 52.0918 18.7085 177.6149 36 P 3.6539 0.0000 0.0000 65.2441 32.5716 178.5854 37 V 3.4913 7.2424 117.8168 66.7052 32.6410 178.5375 38 A 4.0464 7.8141 120.7600 54.8360 18.3479 179.5761 39 V 3.4915 7.4104 115.5641 66.3872 31.9244 177.9757 40 A 4.0850 8.0478 119.6804 54.7108 18.0601 179.2269 41 A 3.8783 7.9993 119.4758 56.0636 18.3106 178.8973 42 A 3.8598 8.2866 118.2274 55.2375 18.2177 177.6822 43 P 4.1204 0.0000 0.0000 65.6797 31.5303 178.5653 44 V 3.5269 7.9204 116.4806 66.2983 31.3106 177.5916 45 A 4.0611 8.3919 120.5329 55.3513 18.0315 179.6594 46 G 3.5960 8.2530 103.7360 47.9797 0.0000 175.4048 47 A 3.9750 8.0922 123.8011 54.6949 18.3112 179.4495 48 A 3.8850 8.2557 118.9948 55.2740 18.4042 179.3180 49 A 4.0156 8.3459 119.7459 55.5014 18.3719 179.6407 50 G 4.2532 8.3247 103.7976 47.6406 0.0000 175.1599 51 A 3.9424 8.1738 123.9836 54.7525 18.3039 179.2847 52 A 3.8855 8.1248 119.1403 55.9219 18.4224 179.3088 53 Q 3.8279 8.1498 116.1908 59.3263 28.5560 178.9778 54 E 3.9353 8.2668 119.3936 60.3745 29.7636 179.0848 55 E 3.9629 8.2187 117.6349 57.4711 29.6063 177.0914 56 K 3.9175 7.3890 128.2870 56.7149 33.3910 175.7798 57 T 4.3439 7.3356 112.3334 59.1089 68.2586 174.4750 58 E 5.7668 6.4395 127.6680 57.0716 32.2516 176.9917 59 F 4.9248 8.6638 121.6284 55.7001 43.4639 173.8917 60 D 5.1250 8.5520 118.0760 52.7852 44.2898 175.5683 61 V 4.2597 8.9587 125.7804 62.0736 32.4690 174.7565 62 V 4.8363 8.7466 128.9755 61.3308 34.1449 174.3654 63 L 4.7288 9.4644 128.4344 54.0233 42.3415 177.6234 64 K 4.4562 9.4200 124.4748 56.4098 32.9564 177.2810 65 S 5.6497 7.2963 116.5309 57.7515 63.6160 174.9605 66 F 5.0689 8.4916 119.7939 55.7213 41.6574 175.7909 67 G 3.9752 8.8715 112.9190 45.2730 0.0000 172.7285 68 Q 3.6490 9.0534 122.2628 56.5483 26.7252 174.4474 69 N 4.8468 7.5849 112.7113 50.3589 40.6297 177.2397 70 K 4.2864 8.4890 120.2401 60.4596 32.2437 177.7010 71 I 3.7402 8.0635 119.5020 64.1432 36.7991 177.7061 72 Q 3.9997 8.0605 117.4220 59.8796 28.3822 179.4353 73 V 3.5348 8.0796 120.3963 65.6585 31.4753 177.9262 74 I 3.8854 8.3467 119.8136 64.2877 36.8185 178.3080 75 K 3.8898 8.2215 119.4678 59.5890 31.8730 179.1687 76 V 3.5651 7.8914 118.2637 66.1389 31.3529 178.0637 77 V 3.6168 8.1372 118.0353 66.1950 31.3136 177.8401 78 R 3.9312 8.3050 117.8949 59.5202 29.7484 178.7397 79 E 3.9563 8.2266 117.2188 59.5499 29.6167 179.1700 80 I 3.8517 7.7974 118.9344 64.6413 37.3719 177.9138 81 T 4.3253 8.1847 108.1295 61.2117 70.1668 174.4642 82 G 3.6996 8.4391 108.8793 46.2985 0.0000 173.4290 83 L 4.6255 7.5426 117.0413 52.1952 44.2025 178.0381 84 G 4.0087 8.3516 110.1189 44.9568 0.0000 173.5802 85 L 3.9602 8.5625 118.7912 58.0209 41.4322 179.7388 86 K 3.8193 8.0108 117.0572 59.9162 32.1165 178.6868 87 E 3.9108 8.2667 117.5201 59.6110 29.3634 179.1433 88 A 3.9920 8.2056 120.5726 55.3032 18.3601 179.7520 89 K 3.8023 8.1745 116.7710 59.7071 32.0640 178.9397 90 D 4.3324 8.2168 119.1992 57.6115 40.7597 178.8313 91 L 3.9130 8.1608 119.0628 58.0794 41.5013 179.7043 92 V 3.3887 7.6485 117.0790 66.1355 31.4529 177.4627 93 E 3.8514 7.8418 116.6472 59.5919 29.5948 179.0604 94 K 4.1311 8.2256 118.1617 58.8180 32.0767 174.6588 95 A 4.5267 6.7497 122.9500 53.9205 18.5738 177.2428 96 G 4.8835 8.2978 124.2731 47.8482 0.0000 171.9541 97 S 4.4336 7.7617 115.4489 56.8385 63.8661 173.4173 98 P 4.2491 0.0000 0.0000 66.1243 30.5743 177.0978 99 D 4.6027 8.0878 115.9258 54.5589 40.9668 178.4727 100 A 4.3561 7.8522 124.3073 51.7535 17.3809 178.3784 101 V 4.1267 8.8705 122.2688 63.4349 29.9338 175.0063 102 I 3.7620 8.1883 126.8732 63.4120 38.1178 176.2046 103 K 4.4094 8.5958 120.5082 55.2958 34.9555 174.7094 104 S 4.8713 8.8555 119.2489 57.7070 65.3251 174.4221 105 G 3.8216 9.7251 111.9751 45.7510 0.0000 173.1381 106 V 4.4334 7.1865 117.8875 60.0751 35.3729 174.7812 107 S 4.9034 8.4519 121.6469 57.7162 64.9035 175.5604 108 K 3.1774 8.4854 120.2858 59.6308 31.5830 179.0188 109 E 3.8664 8.0317 117.8607 59.6438 29.3929 179.0329 110 E 4.8060 8.0084 118.7532 58.9559 29.4947 179.5005 111 A 3.9384 8.2055 120.7971 55.2105 18.4008 179.2582 112 E 3.8016 8.1678 117.3127 60.1638 29.4641 178.9124 113 E 3.8566 8.3126 117.9764 59.7155 29.4407 179.2423 114 I 3.6602 8.2149 119.2691 64.7704 37.3626 178.3377 115 K 3.8398 8.1940 118.9429 59.6008 31.8507 179.3608 116 K 3.8816 8.2137 118.5998 59.3786 31.8928 179.3758 117 K 3.8891 8.1423 118.7744 59.4917 32.1341 179.3028 118 L 3.8304 8.0018 118.9619 58.3438 41.5641 178.7605 119 E 4.5902 8.1806 119.2009 59.2563 29.1531 179.1286 120 E 3.8651 8.4966 119.0525 59.9825 29.9331 179.1393 121 A 4.1637 7.8142 119.2536 55.0109 18.5530 176.4864 122 G 3.0340 6.7786 106.8178 45.1411 0.0000 172.6452 123 A 4.8496 7.7437 120.9952 49.8164 23.4259 175.5196 124 E 4.9078 8.8834 118.8507 54.7601 31.5851 175.9377 125 V 5.0295 8.3022 123.3545 61.1489 35.2913 174.0661 126 E 4.8379 9.1449 120.8516 54.7215 33.2227 174.1017 127 L 4.8490 8.6914 123.5162 54.7718 41.6994 176.5999 128 K 4.1717 8.8981 123.4397 56.8529 32.8227 175.1059 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 8.29 4.51 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 2 T 7.36 4.56 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 1.23 0.00 0.00 3 I 9.43 3.57 1.86 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 1.63 0.62 0.90 0.00 0.00 4 D 8.09 4.39 0.00 2.75 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 5 E 7.63 4.69 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.21 0.00 6 I 8.08 3.66 1.93 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 1.52 1.05 0.91 0.00 0.00 7 I 8.00 3.67 2.05 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 1.51 0.95 0.94 0.00 0.00 8 E 8.37 3.93 0.00 2.16 2.01 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 2.33 2.60 0.00 9 A 8.21 3.97 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 10 I 7.74 3.63 1.98 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 1.52 0.86 0.91 0.00 0.00 11 E 8.24 3.99 0.00 2.17 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 2.35 2.57 0.00 12 K 8.44 4.28 0.00 1.70 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.62 7.81 13 L 8.04 4.73 0.00 1.80 1.71 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.67 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 1.21 0.00 0.00 15 V 8.47 3.50 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 1.21 0.00 0.00 0.92 0.00 0.00 16 S 7.99 4.10 0.00 4.09 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 17 E 8.11 3.95 0.00 2.15 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 2.41 2.41 0.00 18 L 8.23 3.95 0.00 1.87 1.71 0.97 1.06 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 19 A 8.34 4.00 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 20 E 8.46 3.91 0.00 2.15 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 2.34 2.36 0.00 21 L 8.25 4.05 0.00 1.97 1.73 0.93 1.13 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 22 V 8.07 3.58 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1.02 0.00 0.00 23 K 8.25 3.93 0.00 2.05 1.87 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.53 7.81 24 K 8.49 3.78 0.00 1.88 1.80 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.70 7.81 25 L 8.69 4.20 0.00 1.86 1.90 1.01 1.42 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 26 E 8.47 4.06 0.00 2.33 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 2.38 2.55 0.00 27 D 8.12 3.94 0.00 2.78 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 28 K 8.40 4.10 0.00 1.71 1.34 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.59 7.81 29 F 7.61 4.82 0.00 3.04 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 30 G 9.14 4.03 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 0.00 31 V 8.14 4.11 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 0.86 0.00 0.00 0.95 0.00 0.00 32 T 8.48 4.69 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 1.22 0.00 0.00 33 A 8.05 3.99 1.47 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 0.00 0.00 34 A 8.07 4.33 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.92 4.79 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 36 P 0.00 3.65 0.00 2.10 1.89 0.00 3.53 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 37 V 7.24 3.49 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 0.94 0.00 0.00 0.79 0.00 0.00 38 A 7.81 4.05 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 39 V 7.41 3.49 2.30 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 0.84 0.00 0.00 0.92 0.00 0.00 40 A 8.05 4.09 1.33 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 0.00 0.00 41 A 8.00 3.88 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 42 A 8.29 3.86 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 43 P 0.00 4.12 0.00 2.25 2.15 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 44 V 7.92 3.53 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 1.16 0.00 0.00 1.01 0.00 0.00 45 A 8.39 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.25 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 0.00 0.00 0.00 47 A 8.09 3.97 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 48 A 8.26 3.89 1.33 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 0.00 0.00 49 A 8.35 4.02 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 50 G 8.32 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 0.00 0.00 0.00 0.00 51 A 8.17 3.94 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 52 A 8.12 3.89 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 53 Q 8.15 3.83 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 54 E 8.27 3.94 0.00 1.90 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 2.33 2.35 0.00 55 E 8.22 3.96 0.00 2.08 1.87 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 2.31 2.42 0.00 56 K 7.39 3.92 0.00 1.71 1.83 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.99 0.97 7.81 57 T 7.34 4.34 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 58 E 6.44 5.77 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 59 F 8.66 4.92 0.00 3.05 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 60 D 8.55 5.12 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.96 4.26 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 1.02 0.00 0.00 1.00 0.00 0.00 62 V 8.75 4.84 2.22 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 1.11 0.00 0.00 1.04 0.00 0.00 63 L 9.46 4.73 0.00 1.68 1.83 1.30 0.71 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 64 K 9.42 4.46 0.00 1.78 1.89 0.00 1.85 0.00 0.00 2.33 0.00 0.00 3.17 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.40 7.81 65 S 7.30 5.65 0.00 4.21 4.15 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 66 F 8.49 5.07 0.00 2.86 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 67 G 8.87 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 68 Q 9.05 3.65 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.42 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 69 N 7.58 4.85 0.00 2.92 3.02 0.00 0.00 7.03 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.49 4.29 0.00 1.85 1.89 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.67 1.64 7.81 71 I 8.06 3.74 1.90 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 1.71 0.61 0.93 0.00 0.00 72 Q 8.06 4.00 0.00 2.33 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.78 0.00 73 V 8.08 3.53 2.33 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 0.52 0.00 0.00 1.03 0.00 0.00 74 I 8.35 3.89 2.11 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.93 0.93 0.00 0.00 75 K 8.22 3.89 0.00 2.00 1.89 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.78 7.81 76 V 7.89 3.57 2.27 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 1.11 0.00 0.00 0.99 0.00 0.00 77 V 8.14 3.62 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 1.14 0.00 0.00 1.21 0.00 0.00 78 R 8.31 3.93 0.00 2.07 1.99 0.00 3.21 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 79 E 8.23 3.96 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 80 I 7.80 3.85 2.21 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.47 0.96 0.00 0.00 81 T 8.18 4.33 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 1.27 0.00 0.00 82 G 8.44 3.70 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 0.00 0.00 0.00 83 L 7.54 4.63 0.00 1.63 1.59 0.94 0.97 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 84 G 8.35 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 0.00 0.00 0.00 85 L 8.56 3.96 0.00 1.70 1.70 0.92 0.97 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 86 K 8.01 3.82 0.00 1.79 1.87 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.55 7.81 87 E 8.27 3.91 0.00 2.13 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 2.41 2.40 0.00 88 A 8.21 3.99 1.47 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 0.00 0.00 89 K 8.17 3.80 0.00 1.93 1.82 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 90 D 8.22 4.33 0.00 2.88 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 91 L 8.16 3.91 0.00 1.82 1.73 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 92 V 7.65 3.39 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 -0.44 0.00 0.00 1.05 0.00 0.00 93 E 7.84 3.85 0.00 2.07 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 2.21 2.42 0.00 94 K 8.23 4.13 0.00 1.94 1.89 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.70 7.81 95 A 6.75 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.30 4.88 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 0.00 0.00 0.00 97 S 7.76 4.43 0.00 4.01 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 98 P 0.00 4.25 0.00 2.20 2.23 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 99 D 8.09 4.60 0.00 2.82 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 0.00 100 A 7.85 4.36 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.13 2.11 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 0.89 0.00 0.00 1.06 0.00 0.00 102 I 8.19 3.76 1.93 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 1.46 1.00 0.99 0.00 0.00 103 K 8.60 4.41 0.00 1.82 1.68 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.39 7.81 104 S 8.86 4.87 0.00 4.15 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 0.00 105 G 9.73 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 0.00 106 V 7.19 4.43 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 1.17 0.00 0.00 0.96 0.00 0.00 107 S 8.45 4.90 0.00 4.12 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 0.00 108 K 8.49 3.18 0.00 1.70 1.66 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.30 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.69 1.61 7.81 109 E 8.03 3.87 0.00 1.97 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 2.36 2.37 0.00 110 E 8.01 4.81 0.00 2.13 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 2.44 2.19 0.00 111 A 8.21 3.94 1.33 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 0.00 0.00 112 E 8.17 3.80 0.00 2.12 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 2.21 2.41 0.00 113 E 8.31 3.86 0.00 2.22 1.95 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 2.31 2.58 0.00 114 I 8.21 3.66 1.97 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 1.52 0.84 0.91 0.00 0.00 115 K 8.19 3.84 0.00 1.88 1.84 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.73 7.81 116 K 8.21 3.88 0.00 2.00 1.83 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.70 7.81 117 K 8.14 3.89 0.00 1.95 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.60 7.81 118 L 8.00 3.83 0.00 1.54 1.52 0.90 0.91 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 0.00 119 E 8.18 4.59 0.00 2.14 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 2.28 2.38 0.00 120 E 8.50 3.87 0.00 2.08 2.01 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 2.33 2.46 0.00 121 A 7.81 4.16 1.38 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 0.00 122 G 6.78 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 0.00 0.00 0.00 123 A 7.74 4.85 0.34 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 0.00 124 E 8.88 4.91 0.00 1.90 1.85 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 2.21 2.20 0.00 125 V 8.30 5.03 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 0.88 0.00 0.00 0.91 0.00 0.00 126 E 9.14 4.84 0.00 2.03 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 2.21 2.28 0.00 127 L 8.69 4.85 0.00 1.81 1.77 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.90 4.17 0.00 1.98 1.78 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.60 1.33 7.81