NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3646 8.3044 120.3251 55.8396 32.7921 174.9687 2 H 4.4563 8.0781 127.4869 53.8651 28.8281 173.2951 3 L 4.4647 7.1692 120.2766 53.4057 43.3480 177.1844 4 T 4.0406 8.9512 115.1623 60.4612 69.8798 173.6881 5 P 4.1767 0.0000 0.0000 66.0866 30.7878 178.8046 6 E 4.0267 8.0899 115.3414 59.2184 29.4963 178.8094 7 E 3.9679 8.2285 120.0543 58.9371 29.5306 178.9523 8 K 3.8975 7.8724 119.6129 59.2517 32.2450 178.9546 9 S 4.1136 8.1638 114.6161 61.3134 62.8630 176.3916 10 A 3.9784 7.6875 123.6903 54.6469 18.0995 179.8293 11 V 3.2590 7.6531 116.7823 66.4140 31.3838 178.4495 12 T 3.9599 7.4633 113.4322 66.5649 68.4512 176.2744 13 A 4.1760 8.3977 123.0770 55.1079 18.3847 179.5188 14 L 3.7772 7.8084 118.9928 57.9555 41.9709 178.8623 15 W 4.4999 8.7425 128.1720 60.0664 30.3223 178.0495 16 G 3.7729 7.7732 105.2504 47.3248 0.0000 174.5076 17 K 4.3491 8.1085 118.6393 56.8443 32.8080 177.2695 18 V 3.6789 7.0627 118.2795 62.4367 32.0073 176.0697 19 N 4.6168 8.1510 124.9485 51.9180 38.4326 175.3858 20 V 3.6231 8.0066 121.1569 64.1455 31.2341 177.5201 21 D 4.3510 8.1697 118.0670 57.4445 40.8118 178.4021 22 E 3.8702 7.9952 119.2327 59.4010 29.6849 178.9138 23 V 3.5582 8.1377 118.8495 65.8248 31.5257 178.0340 24 G 3.7553 8.3425 105.7757 47.8656 0.0000 175.9155 25 G 3.5655 7.7461 107.4446 47.4346 0.0000 175.7447 26 E 3.9157 8.0905 120.8243 58.9393 29.4829 179.3549 27 A 3.9118 8.1374 120.9317 55.0500 18.6239 179.4491 28 L 3.9499 7.8788 118.9391 58.1370 42.2844 179.1956 29 G 3.6215 8.2256 105.8273 48.1690 0.0000 175.7389 30 R 3.9220 8.2104 121.4828 58.5807 30.0042 179.0451 31 L 4.0600 7.8469 120.1775 58.2502 42.0368 179.1072 32 L 4.0391 7.8655 118.4591 57.1480 41.2102 179.6771 33 V 3.6824 7.3653 117.4058 65.7171 31.7765 178.0689 34 G 3.2935 8.0091 104.3925 46.2925 0.0000 173.3329 35 Y 3.9093 7.3275 118.5758 53.6679 38.1759 174.0872 36 P 4.6222 0.0000 0.0000 64.5134 31.5157 178.4603 37 W 4.3250 8.1496 116.6800 59.6306 27.5267 177.8670 38 T 4.1680 7.8265 110.2721 63.9384 68.1324 175.7417 39 Q 4.4332 8.1882 121.0913 57.4662 28.5028 177.9558 40 R 3.7989 7.6175 117.4005 58.6757 29.3456 177.9322 41 F 4.2395 6.9796 115.4924 57.4353 40.0327 175.5894 42 F 4.6229 7.6130 118.5669 56.6384 39.3030 176.5013 43 E 4.2345 8.2076 118.1991 57.9874 30.0514 177.4025 44 S 4.6597 7.9471 113.0186 58.6512 63.6983 174.6913 45 F 4.6362 8.2348 119.4570 58.6275 39.9538 176.8539 46 G 3.9535 8.1207 106.4146 44.4414 0.0000 174.3775 47 D 4.4609 8.6078 125.9014 54.5403 40.0463 175.5660 48 L 4.8810 8.3698 125.9907 54.3319 43.0186 178.8926 49 S 4.3181 8.1448 116.8593 60.9516 63.1325 174.5307 50 T 4.7389 7.3307 107.1807 58.1690 73.1668 172.9040 51 P 4.2183 0.0000 0.0000 66.0303 31.3179 178.7605 52 D 4.3749 8.0586 116.8220 57.2630 40.5865 178.4757 53 A 4.0181 7.7265 120.1963 54.9689 18.4491 179.6546 54 V 3.7148 7.8274 116.8014 66.4065 31.5841 178.0599 55 M 4.1092 8.4724 117.9257 57.9818 31.9509 178.2227 56 G 4.0068 7.8902 102.9781 43.6132 0.0000 173.3367 57 N 4.3221 7.4647 121.3999 53.0067 39.4540 173.4940 58 P 4.2263 0.0000 0.0000 66.1620 31.1403 178.6124 59 K 3.6173 8.2970 118.1876 58.9693 31.7208 179.5355 60 V 3.6815 7.6522 118.0979 65.8020 31.6015 178.1176 61 K 3.9193 8.0233 118.1084 59.3848 31.7785 179.2406 62 A 3.9731 7.8590 121.0576 55.3313 18.2717 179.2557 63 H 4.2760 8.3712 116.9255 59.3144 29.9724 177.4449 64 G 3.7841 8.3990 108.0234 48.0369 0.0000 175.4615 65 K 3.9814 7.9388 121.4617 58.8105 32.1890 178.9137 66 K 3.9045 7.7628 120.1226 59.4864 32.2421 178.7559 67 V 3.6573 8.0802 118.8936 66.3674 31.3912 178.0647 68 L 4.3847 8.3694 118.3553 57.1396 41.5200 179.7615 69 G 3.6916 8.1468 106.1000 47.8917 0.0000 175.6734 70 A 4.1428 8.2295 123.9933 54.6191 18.5309 179.4516 71 F 4.2818 8.5814 119.2405 61.7243 39.2825 177.5043 72 S 4.2659 8.6892 114.0461 61.8974 63.0472 176.1861 73 D 4.6038 8.2734 121.2441 57.1937 40.4822 179.0487 74 G 3.4866 7.8387 105.9961 47.5867 0.0000 175.4075 75 L 3.9018 7.3145 118.6526 55.9921 41.6531 178.0690 76 A 4.4624 7.3831 119.2452 52.0127 20.1539 176.2879 77 H 4.8496 7.8950 115.3473 54.5700 29.8887 175.1953 78 L 4.0715 8.0452 121.9225 57.7143 42.3105 177.3722 79 D 4.4896 7.9140 117.2912 56.6256 41.7259 176.1814 80 N 4.9789 8.3565 116.9467 51.1887 39.1769 174.4760 81 L 4.0074 7.8388 123.0828 57.5894 42.1690 179.0447 82 K 3.9254 8.0523 116.9686 59.3707 32.2897 179.1550 83 G 3.6768 7.9419 105.7055 48.1341 0.0000 175.5343 84 T 3.6521 7.5735 117.7338 66.0517 68.8205 175.7609 85 F 4.6892 8.4117 117.0042 57.3567 39.2535 177.4975 86 A 4.1703 7.8527 122.9325 55.6794 18.2387 180.3131 87 T 3.9306 7.8753 107.7054 64.6296 68.8933 176.5658 88 L 4.0429 7.9161 122.9098 57.8958 42.3108 178.4585 89 S 4.3856 8.5675 114.8760 60.9750 62.3096 176.0230 90 E 3.8716 8.0702 120.7544 59.2344 29.1158 179.1571 91 L 3.8905 7.9719 120.2124 58.6244 42.1543 178.7051 92 H 4.1082 8.5451 116.3778 59.5219 28.0994 176.7242 93 C 3.5965 7.8057 120.7916 62.0192 31.0109 175.2595 94 D 4.3626 8.5941 122.5779 56.4188 40.7121 177.5347 95 K 4.2866 8.0216 117.4042 57.7550 33.5443 177.6637 96 L 4.0625 7.7206 116.5030 55.3299 42.3852 176.2713 97 H 4.1175 7.2435 113.4731 56.6636 26.4588 175.7072 98 V 3.7599 7.9495 118.6712 60.8910 32.1142 174.8161 99 D 4.3202 8.7892 127.5486 53.9604 41.5624 175.2966 100 P 3.2457 0.0000 0.0000 64.9156 31.7676 177.9837 101 E 3.8931 8.1635 118.8048 59.1818 29.2836 178.4814 102 N 4.2671 7.9790 116.7284 56.2784 38.6308 177.2587 103 F 4.4947 7.4513 119.4200 60.3794 38.9434 177.8461 104 R 4.0692 7.8138 115.4736 58.8736 29.5700 178.6920 105 L 3.7362 7.8379 119.7300 57.5499 41.6415 179.0802 106 L 4.0757 8.0655 120.3201 58.1475 41.9675 179.2145 107 G 3.7009 8.0389 105.1816 47.9905 0.0000 175.4574 108 N 4.4404 8.1815 119.0514 55.8550 38.4985 177.6959 109 V 3.5867 7.8738 119.6907 65.9319 31.5885 177.6654 110 L 3.8473 8.3413 120.4125 58.2805 41.8908 179.0769 111 V 3.5180 7.8877 117.9643 66.3226 31.3817 177.7998 112 C 4.1444 8.1175 116.4417 62.6318 27.8745 176.3300 113 V 3.5213 7.7934 120.0388 65.9756 31.0561 178.1527 114 L 3.8642 7.8688 118.7060 57.4697 41.2852 179.4160 115 A 3.6793 7.3055 120.7132 55.1442 18.1048 178.9226 116 H 4.0494 8.1303 115.9203 59.9439 29.9715 176.9062 117 H 4.0111 8.0835 116.2324 58.5484 28.9413 177.2081 118 F 4.5077 8.6517 117.9861 56.9644 39.5086 177.2998 119 G 3.7889 8.6624 109.0215 46.0114 0.0000 176.9752 120 K 3.9033 8.9293 123.6210 58.9350 32.0754 177.3550 121 E 4.1306 8.2090 118.6816 58.4013 30.0087 177.0183 122 F 4.5855 8.0503 123.3718 56.9774 37.8662 175.5169 123 T 4.1669 7.3994 115.3661 60.1543 71.2897 173.4169 124 P 4.1792 0.0000 0.0000 65.8101 31.2546 177.2402 125 P 4.2686 0.0000 0.0000 65.2595 31.2136 178.8764 126 V 3.5587 7.1256 116.5273 65.5649 31.3718 177.8517 127 Q 3.5383 7.9670 119.6068 58.9985 28.8404 178.0915 128 A 4.0588 7.9745 121.5683 55.0225 18.4582 179.5762 129 A 3.8531 7.7325 119.3475 55.6292 18.4497 179.5190 130 Y 3.9029 8.1810 115.2817 61.0933 37.9947 178.8164 131 Q 4.1168 8.7156 119.5408 59.0938 28.8698 179.0493 132 K 3.9722 7.8769 119.0031 59.4067 31.9565 179.6497 133 V 3.4805 7.5861 118.0622 66.1868 31.4445 178.6196 134 V 3.8041 8.3667 112.3610 64.2416 31.2377 178.5526 135 A 4.0969 8.0644 120.4070 55.0790 18.1822 179.8545 136 G 3.5215 8.1950 104.3637 47.9155 0.0000 176.1153 137 V 3.3152 8.0659 120.7428 65.5256 31.3181 177.9005 138 A 3.9037 8.0067 119.6681 55.2769 18.4605 179.0407 139 N 4.4150 8.4470 114.9175 56.4726 38.1946 177.5334 140 A 4.0363 8.1978 122.3951 55.1145 18.4500 179.4419 141 L 3.9140 8.1426 116.7408 56.4418 41.6338 178.3052 142 A 4.7443 7.6654 119.6702 52.5153 19.4579 178.1701 143 H 4.2368 7.9098 113.0988 58.2433 28.3823 176.2398 144 K 4.3550 7.8251 117.9870 56.1131 32.1594 176.3767 145 Y 4.2193 8.1053 117.7404 58.4466 38.4773 175.5593 146 H 4.4020 8.3732 116.9494 56.3747 28.0233 173.5765 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 8.30 4.36 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 8.08 4.46 0.00 3.15 3.22 0.00 5.72 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.17 4.46 0.00 1.56 1.51 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.95 4.04 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 1.10 0.00 0.00 5 P 0.00 4.18 0.00 2.14 2.13 0.00 3.55 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 2.09 2.13 0.00 6 E 8.09 4.03 0.00 2.13 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 0.00 2.32 2.32 0.00 7 E 8.23 3.97 0.00 2.21 1.93 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 2.27 2.25 0.00 8 K 7.87 3.90 0.00 1.73 1.97 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.41 7.81 9 S 8.16 4.11 0.00 4.09 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 0.00 10 A 7.69 3.98 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 11 V 7.65 3.26 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.41 0.00 0.00 12 T 7.46 3.96 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 1.25 0.00 0.00 13 A 8.40 4.18 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 14 L 7.81 3.78 0.00 1.78 1.91 0.40 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.50 0.00 3.82 3.21 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 16 G 7.77 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 17 K 8.11 4.35 0.00 2.13 2.13 0.00 1.80 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.68 7.81 18 V 7.06 3.68 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 -0.02 0.00 0.00 0.65 0.00 0.00 19 N 8.15 4.62 0.00 2.71 2.61 0.00 0.00 7.16 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 20 V 8.01 3.62 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 0.76 0.00 0.00 1.01 0.00 0.00 21 D 8.17 4.35 0.00 2.86 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 22 E 8.00 3.87 0.00 1.97 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 2.29 2.29 0.00 23 V 8.14 3.56 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 0.90 0.00 0.00 0.67 0.00 0.00 24 G 8.34 3.76 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 0.00 0.00 0.00 25 G 7.75 3.57 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 0.00 0.00 0.00 26 E 8.09 3.92 0.00 2.23 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 2.48 0.00 27 A 8.14 3.91 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 28 L 7.88 3.95 0.00 1.79 1.65 0.92 1.12 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 29 G 8.23 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 30 R 8.21 3.92 0.00 1.93 1.96 0.00 3.08 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 31 L 7.85 4.06 0.00 1.83 1.85 0.96 0.76 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 32 L 7.87 4.04 0.00 1.88 1.70 0.71 0.78 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 33 V 7.37 3.68 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 0.74 0.00 0.00 0.92 0.00 0.00 34 G 8.01 3.29 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 0.00 0.00 0.00 0.00 35 Y 7.33 3.91 0.00 2.36 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 36 P 0.00 4.62 0.00 2.33 2.33 0.00 3.77 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 2.20 1.90 0.00 37 W 8.15 4.33 0.00 3.54 3.46 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 38 T 7.83 4.17 4.37 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 0.00 0.00 0.00 0.97 0.00 0.00 39 Q 8.19 4.43 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 40 R 7.62 3.80 0.00 1.54 1.83 0.00 3.02 0.00 0.00 2.78 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 0.00 41 F 6.98 4.24 0.00 1.65 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 0.00 0.00 0.00 0.00 42 F 7.61 4.62 0.00 2.88 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 0.00 0.00 0.00 0.00 43 E 8.21 4.23 0.00 2.09 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 2.24 2.30 0.00 44 S 7.95 4.66 0.00 4.13 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 45 F 8.23 4.64 0.00 3.21 3.15 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 46 G 8.12 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 47 D 8.61 4.46 0.00 2.67 2.64 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 48 L 8.37 4.88 0.00 1.74 1.61 1.02 0.93 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 49 S 8.14 4.32 0.00 3.94 4.08 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 50 T 7.33 4.74 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 51 P 0.00 4.22 0.00 2.15 2.11 0.00 3.58 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 2.09 2.16 0.00 52 D 8.06 4.37 0.00 2.67 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 53 A 7.73 4.02 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 54 V 7.83 3.71 2.21 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 1.04 0.00 0.00 1.02 0.00 0.00 55 M 8.47 4.11 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.86 0.00 56 G 7.89 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 57 N 7.46 4.32 0.00 2.98 2.86 0.00 0.00 6.79 8.46 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 58 P 0.00 4.23 0.00 2.23 2.26 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 59 K 8.30 3.62 0.00 1.41 0.74 0.00 1.73 0.00 0.00 1.29 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.17 1.24 7.81 60 V 7.65 3.68 2.21 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 1.17 0.00 0.00 1.05 0.00 0.00 61 K 8.02 3.92 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.62 7.81 62 A 7.86 3.97 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 63 H 8.37 4.28 0.00 3.51 3.48 0.00 5.81 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 64 G 8.40 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 0.00 0.00 0.00 65 K 7.94 3.98 0.00 1.85 2.07 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.66 7.81 66 K 7.76 3.90 0.00 1.98 2.00 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 8.08 3.66 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 1.02 0.00 0.00 0.93 0.00 0.00 68 L 8.37 4.38 0.00 2.00 1.85 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.15 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 70 A 8.23 4.14 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 0.00 0.00 0.00 0.00 0.00 71 F 8.58 4.28 0.00 3.25 3.29 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 0.00 72 S 8.69 4.27 0.00 4.24 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 0.00 73 D 8.27 4.60 0.00 2.94 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 74 G 7.84 3.49 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 0.00 0.00 0.00 75 L 7.31 3.90 0.00 1.61 1.44 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.38 4.46 1.12 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 0.00 0.00 77 H 7.90 4.85 0.00 3.08 3.14 0.00 5.83 0.00 0.00 0.00 0.00 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.05 4.07 0.00 1.47 1.62 0.76 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.49 0.00 2.67 2.67 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 80 N 8.36 4.98 0.00 2.65 2.58 0.00 0.00 7.14 6.45 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 81 L 7.84 4.01 0.00 1.75 1.82 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.05 3.93 0.00 1.63 1.58 0.00 1.70 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.46 7.81 83 G 7.94 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 84 T 7.57 3.65 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 0.50 0.00 0.00 85 F 8.41 4.69 0.00 3.21 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 86 A 7.85 4.17 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.88 3.93 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 1.21 0.00 0.00 88 L 7.92 4.04 0.00 1.92 1.94 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.57 4.39 0.00 4.13 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 90 E 8.07 3.87 0.00 2.31 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 2.30 2.46 0.00 91 L 7.97 3.89 0.00 1.89 1.86 0.92 1.00 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 92 H 8.55 4.11 0.00 3.71 3.80 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.81 3.60 0.00 1.25 2.48 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 0.00 0.00 0.00 0.00 94 D 8.59 4.36 0.00 2.70 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 95 K 8.02 4.29 0.00 1.76 1.78 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.72 4.06 0.00 1.68 1.61 0.67 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.24 4.12 0.00 3.45 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.95 3.76 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 0.12 0.00 0.00 0.37 0.00 0.00 99 D 8.79 4.32 0.00 2.82 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 0.00 100 P 0.00 3.25 0.00 1.94 1.83 0.00 3.38 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.47 0.00 101 E 8.16 3.89 0.00 2.04 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 2.33 2.41 0.00 102 N 7.98 4.27 0.00 2.52 2.68 0.00 0.00 6.88 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 0.00 103 F 7.45 4.49 0.00 3.07 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 0.00 104 R 7.81 4.07 0.00 2.03 2.20 0.00 2.96 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.05 0.00 105 L 7.84 3.74 0.00 1.70 1.34 0.58 -0.03 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 0.00 106 L 8.07 4.08 0.00 1.81 1.73 0.93 0.95 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 0.00 107 G 8.04 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 0.00 108 N 8.18 4.44 0.00 2.79 2.93 0.00 0.00 6.68 7.70 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 0.00 109 V 7.87 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 1.13 0.00 0.00 1.16 0.00 0.00 110 L 8.34 3.85 0.00 1.68 1.80 0.85 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.89 3.52 2.31 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 1.31 0.00 0.00 1.18 0.00 0.00 112 C 8.12 4.14 0.00 3.18 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 0.00 113 V 7.79 3.52 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 0.84 0.00 0.00 0.94 0.00 0.00 114 L 7.87 3.86 0.00 0.87 1.07 0.57 1.16 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 0.00 115 A 7.31 3.68 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 0.00 116 H 8.13 4.05 0.00 3.20 3.55 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.08 4.01 0.00 2.78 2.67 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.65 4.51 0.00 3.34 3.17 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 0.00 119 G 8.66 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 0.00 120 K 8.93 3.90 0.00 1.77 1.92 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.42 7.81 121 E 8.21 4.13 0.00 2.36 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 0.00 2.40 2.34 0.00 122 F 8.05 4.59 0.00 3.09 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 0.00 123 T 7.40 4.17 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 1.27 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.17 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 125 P 0.00 4.27 0.00 2.11 2.06 0.00 3.46 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 2.08 2.11 0.00 126 V 7.13 3.56 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 0.85 0.00 0.00 0.89 0.00 0.00 127 Q 7.97 3.54 0.00 1.81 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 128 A 7.97 4.06 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 0.00 129 A 7.73 3.85 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 0.00 130 Y 8.18 3.90 0.00 3.46 3.28 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 0.00 131 Q 8.72 4.12 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 7.88 3.97 0.00 1.93 1.83 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.62 7.81 133 V 7.59 3.48 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 0.89 0.00 0.00 0.74 0.00 0.00 134 V 8.37 3.80 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 1.07 0.00 0.00 1.12 0.00 0.00 135 A 8.06 4.10 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 0.00 136 G 8.19 3.52 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 0.00 137 V 8.07 3.32 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 0.64 0.00 0.00 0.60 0.00 0.00 138 A 8.01 3.90 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 0.00 139 N 8.45 4.42 0.00 2.92 2.88 0.00 0.00 6.93 8.54 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 0.00 140 A 8.20 4.04 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 0.00 141 L 8.14 3.91 0.00 1.06 0.44 0.02 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.67 4.74 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 0.00 143 H 7.91 4.24 0.00 3.36 3.68 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.83 4.36 0.00 1.74 1.82 0.00 1.65 0.00 0.00 1.54 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.82 1.63 7.81 145 Y 8.11 4.22 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 0.00 146 H 8.37 4.40 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00