NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3907 8.3049 118.1930 54.3167 33.2584 175.2516 3 L 4.0462 7.7634 120.8921 53.0441 41.8827 176.0734 4 T 4.1466 9.6250 117.4956 61.0776 71.9214 174.9624 5 A 3.9471 8.4224 122.8858 55.3438 18.0157 179.7543 6 E 3.9177 8.0886 116.5471 59.7112 29.1285 179.3165 7 E 4.0149 8.2017 118.5696 59.1074 29.4683 179.5769 8 K 3.8753 8.2587 118.5421 59.5282 32.1159 179.3268 9 A 4.0257 7.8999 120.2711 54.8650 18.2540 179.5253 10 A 4.0251 7.7123 118.1510 55.0008 18.6508 179.9041 11 V 3.4157 7.3733 116.0886 66.4549 31.0001 178.5069 12 T 3.9929 8.0880 115.1536 66.4904 68.0894 176.5693 13 A 3.9358 8.0621 121.6560 55.2213 18.6931 179.1365 14 F 4.1902 8.5844 119.1361 61.2800 39.5349 176.7914 15 W 4.4749 8.8250 128.1947 60.8243 30.1719 177.8880 16 G 3.7775 7.5720 104.0730 47.4874 0.0000 175.0753 17 K 4.0736 7.5032 119.5602 57.1159 32.3023 177.5932 18 V 3.6108 6.3918 119.7051 62.7496 31.9050 174.9113 19 H 4.5370 8.5798 124.9574 55.5857 29.0487 176.1530 20 V 4.1491 8.1691 117.1209 61.6152 31.5985 177.2890 21 D 4.4202 8.1045 119.6030 57.0405 38.9012 178.4483 22 E 3.9295 7.9322 119.6457 58.6794 29.7994 179.6278 23 V 3.5185 7.6567 117.9333 65.6927 31.5205 178.4004 24 G 3.6710 7.9300 105.5397 47.5088 0.0000 175.9802 25 G 3.6329 7.7209 107.8483 47.6156 0.0000 175.4258 26 E 3.9230 8.1726 122.1061 58.5770 29.5420 178.7134 27 A 3.9052 7.9086 120.8546 55.1993 18.5834 179.4192 28 L 3.9947 8.0611 119.0241 58.0629 42.1181 179.4316 29 G 3.5273 8.1703 105.7541 47.9696 0.0000 176.0166 30 R 3.9080 8.4953 121.2360 58.4329 29.9130 178.9316 31 L 4.0542 8.1762 120.5572 58.3512 42.1456 179.1504 32 L 4.0529 7.7152 120.0443 57.0349 41.2377 179.8293 33 V 3.4890 7.5761 117.5195 65.9875 31.6465 178.0049 34 V 3.6037 7.6129 116.7653 64.0770 32.8700 175.5561 35 Y 4.0950 7.3048 116.1396 54.7554 37.6031 174.2322 36 P 4.8945 0.0000 0.0000 62.9983 31.8987 177.5449 37 W 4.3366 7.8854 116.7598 59.4201 28.0237 178.0694 38 T 4.2780 7.5044 110.5711 64.5577 67.8982 176.2713 39 Q 4.2045 8.0707 121.3876 58.4656 28.3993 178.0444 40 R 3.7210 7.8006 120.0156 59.5641 29.9483 177.0450 41 F 4.3566 7.6145 112.7632 58.2830 39.2577 175.5547 42 F 4.6099 8.1547 120.7692 56.6228 39.7670 177.1022 43 E 3.9828 8.7631 121.8092 59.8654 29.2560 179.8028 44 S 4.4478 8.0601 109.4696 60.0368 63.1158 174.4645 45 F 4.6669 8.4453 119.6168 57.9115 39.7488 176.9489 46 G 4.0251 7.6879 107.0960 45.2116 0.0000 174.2938 47 D 4.5720 8.5842 124.4811 54.2401 41.5494 176.0850 48 L 4.9228 8.2108 126.7700 54.7724 43.3458 177.9650 49 S 4.3330 8.2328 118.2750 60.9236 63.2769 175.0940 50 T 4.7355 7.4576 108.5698 58.6955 73.1626 174.3718 51 A 3.9731 8.4821 122.7298 55.6370 18.3130 179.7634 52 D 4.2766 8.0214 116.5271 57.3462 40.7699 178.7033 53 A 3.9913 7.4796 119.6738 55.0256 18.7936 179.5458 54 V 3.6596 7.8237 116.6978 66.5971 31.4526 178.1585 55 M 4.0243 7.9404 117.1004 58.2545 31.8953 177.3041 56 N 4.6341 7.9763 112.9933 53.1811 39.5246 175.3592 57 N 4.3915 7.8468 118.8125 53.2432 40.0377 173.7674 58 P 4.3166 0.0000 0.0000 65.2095 31.5116 178.9424 59 K 3.6758 8.1934 117.8823 59.0771 31.7284 179.4809 60 V 3.7145 7.8152 118.1056 65.9798 31.5225 178.1530 61 K 3.9515 7.9700 117.5965 59.4124 31.8097 179.2570 62 A 4.0026 8.1696 121.2558 55.3974 18.2478 179.2071 63 H 4.4867 8.7971 117.3884 59.2392 30.0054 177.7031 64 G 3.6828 8.5141 107.9768 47.5040 0.0000 175.4156 65 K 4.0909 8.1045 121.9108 59.5172 32.2160 178.9656 66 K 4.0043 7.7303 117.1951 59.4106 31.9521 179.4330 67 V 3.7124 7.8302 118.4831 66.2331 31.4408 178.0781 68 L 4.5191 8.1931 118.2936 57.4201 41.3841 179.0021 69 D 4.5238 8.5045 119.4947 57.5925 40.6869 178.9628 70 S 4.2362 8.3973 115.6280 61.6101 62.7884 176.6942 71 F 4.0837 8.5511 120.5423 60.8089 38.4715 177.8915 72 S 4.2768 8.6011 113.8778 61.5102 62.3523 176.0307 73 N 4.5736 8.0894 120.1349 56.3572 38.6844 177.1715 74 G 3.6519 8.2204 107.2957 48.2020 0.0000 175.4418 75 M 3.9052 8.0580 120.3950 58.0643 31.9734 178.7361 76 K 4.1119 7.5634 116.2541 58.1454 33.2925 176.7226 77 H 4.9794 8.1152 116.5339 54.7433 29.3404 175.0806 78 L 4.0010 7.8967 119.2038 57.4515 41.9935 178.4577 79 D 4.6816 7.9194 116.0451 54.6634 41.8070 176.2624 80 D 4.7263 8.1076 120.0361 51.7222 41.8341 176.5298 81 L 4.0556 8.0260 121.9548 57.7749 41.5649 179.2475 82 K 4.0156 8.0960 118.1403 59.5836 31.8573 179.4633 83 G 3.5456 7.6637 104.2060 48.0005 0.0000 175.5371 84 T 3.7697 7.6057 117.2368 65.6548 68.6624 175.7686 85 F 4.6848 7.9839 116.8477 56.9705 39.3190 177.2160 86 A 3.9375 7.5793 122.2081 55.4314 18.1782 179.9620 87 A 3.9152 7.9023 118.3436 55.4497 18.5653 179.7743 88 L 4.0301 7.8975 116.9821 57.7077 41.6706 179.5476 89 S 4.1208 8.6385 114.9657 60.7443 62.3551 175.7468 90 E 3.8610 8.0363 121.3256 59.4956 29.2652 179.2594 91 L 3.9039 7.7269 119.6315 58.6850 42.2362 178.8059 92 H 4.1919 8.3853 116.0722 58.3339 28.7053 177.2964 93 C 4.2184 8.0081 119.5470 61.3208 28.2741 175.7602 94 D 4.4036 7.7583 118.4986 56.4028 41.1172 178.3094 95 K 4.1964 8.0020 117.1438 58.6850 32.5415 177.8284 96 L 4.3999 7.8860 115.7206 54.6596 42.4969 176.2471 97 H 4.4229 8.0721 114.1928 55.3183 26.3785 175.2428 98 V 3.6179 7.7793 118.1569 62.2944 32.3356 174.9610 99 D 4.2623 8.7468 127.2495 53.3436 41.8245 175.0776 100 P 2.9700 0.0000 0.0000 65.1574 31.7025 177.8249 101 E 3.8686 8.0629 119.3503 59.4638 29.2653 178.5495 102 N 4.4342 8.0716 116.1995 55.9813 38.4820 177.4039 103 F 4.5178 7.6663 119.6876 60.4210 38.9331 177.8082 104 K 4.0622 8.0809 117.7271 59.3806 31.9018 179.1075 105 L 3.9157 7.8038 119.0925 57.8522 41.4781 179.4539 106 L 4.1303 8.3206 120.4064 57.9365 42.0153 178.9905 107 G 3.8445 8.2522 105.8045 48.0910 0.0000 175.2587 108 N 4.3991 8.6617 119.6550 56.0392 38.5297 177.6367 109 V 3.6379 8.1196 119.7180 65.8705 31.5074 177.6008 110 L 3.8227 8.1552 120.2594 58.1660 41.8372 179.1257 111 V 3.5870 7.7755 117.9868 66.0030 31.4611 177.8717 112 V 3.6163 7.9050 117.9551 66.2781 31.3335 178.1125 113 V 3.5115 7.9622 117.8739 65.9344 31.4271 177.8679 114 L 3.8730 8.0639 118.8381 57.6558 41.3298 179.3955 115 A 4.0997 7.7310 120.6252 55.2225 18.1397 179.7021 116 R 3.8162 7.8938 116.2368 59.8482 30.2065 178.1410 117 H 3.9822 7.9279 115.1546 57.3533 28.9868 176.0413 118 F 4.9630 7.9747 116.3612 56.0175 42.5246 178.4409 119 G 3.8509 8.5877 109.8772 46.0170 0.0000 175.2186 120 K 3.9016 9.5117 122.1489 59.4758 32.2311 176.8204 121 E 4.2173 8.2523 117.2706 59.0764 29.8631 177.6623 122 F 4.4298 8.0257 122.4868 57.1054 37.7222 175.3259 123 T 4.0849 7.3350 115.3780 60.2931 71.2629 173.3180 124 P 4.0916 0.0000 0.0000 65.9898 31.3375 179.0815 125 V 3.4861 7.5619 116.0380 65.8755 31.7315 177.5721 126 L 3.8355 7.5987 120.0423 58.1808 41.8857 178.6707 127 Q 3.3786 7.8611 119.5570 58.7786 28.7016 177.8757 128 A 3.9756 7.8828 121.7552 55.5017 18.1428 179.2343 129 D 4.2720 7.9374 117.0352 57.7446 40.8321 179.1984 130 F 4.1736 8.2590 117.4607 60.1789 38.9515 177.8805 131 Q 4.1256 8.3480 118.1660 58.7250 28.4216 178.6504 132 K 4.0632 7.9097 119.8034 59.1596 31.9540 179.6369 133 V 3.6075 7.4729 118.5842 66.0676 31.4306 178.6303 134 V 3.8909 8.3069 112.2146 64.1840 31.3649 178.3763 135 A 4.1295 8.3148 120.8748 55.1118 18.2466 179.8818 136 G 3.5493 8.1985 104.2598 47.9537 0.0000 176.1344 137 V 3.1991 8.1554 121.1308 65.3456 31.5127 177.8333 138 A 3.9592 8.1723 120.8138 55.3543 18.0132 179.3788 139 N 4.3179 7.9799 113.3832 56.4506 38.4684 177.1279 140 A 4.1000 7.9291 122.1126 55.2822 18.5622 179.7438 141 L 3.6643 7.8970 117.1861 56.9961 41.5645 178.4800 142 A 4.9117 7.6589 118.4471 52.6585 19.0547 178.3579 143 H 3.8430 7.8362 118.1554 59.2572 29.7381 177.3226 144 R 4.0279 7.7507 118.3315 58.5887 30.2822 177.3909 145 Y 4.4989 7.9384 116.1677 60.5895 38.4151 175.4247 146 H 4.3108 7.9908 120.5986 56.4400 28.8517 174.6732 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 M 8.30 4.39 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 3 L 7.76 4.05 0.00 1.68 1.62 0.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.63 4.15 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 1.25 0.00 0.00 5 A 8.42 3.95 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 6 E 8.09 3.92 0.00 1.97 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 2.39 2.34 0.00 7 E 8.20 4.01 0.00 2.22 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 2.57 2.31 0.00 8 K 8.26 3.88 0.00 1.96 1.82 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.52 7.81 9 A 7.90 4.03 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 10 A 7.71 4.03 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 11 V 7.37 3.42 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 0.50 0.00 0.00 0.14 0.00 0.00 12 T 8.09 3.99 4.45 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 1.26 0.00 0.00 13 A 8.06 3.94 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 14 F 8.58 4.19 0.00 3.38 3.47 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 15 W 8.82 4.47 0.00 3.89 3.35 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 16 G 7.57 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 17 K 7.50 4.07 0.00 0.95 1.40 0.00 1.38 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.27 1.16 7.81 18 V 6.39 3.61 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 0.00 0.00 0.22 0.00 0.00 0.21 0.00 0.00 19 H 8.58 4.54 0.00 3.17 3.36 0.00 5.67 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.17 4.15 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 0.78 0.00 0.00 0.92 0.00 0.00 21 D 8.10 4.42 0.00 2.85 2.89 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 22 E 7.93 3.93 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 23 V 7.66 3.52 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 0.88 0.00 0.00 0.67 0.00 0.00 24 G 7.93 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 25 G 7.72 3.63 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 0.00 0.00 0.00 26 E 8.17 3.92 0.00 2.04 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 2.27 2.29 0.00 27 A 7.91 3.91 1.37 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 0.00 0.00 0.00 28 L 8.06 3.99 0.00 1.82 1.67 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.17 3.53 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 30 R 8.50 3.91 0.00 1.99 1.94 0.00 3.10 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 31 L 8.18 4.05 0.00 1.82 1.87 1.01 1.02 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 32 L 7.72 4.05 0.00 1.84 1.65 0.68 0.58 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 33 V 7.58 3.49 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 0.72 0.00 0.00 0.91 0.00 0.00 34 V 7.61 3.60 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 0.01 0.00 0.00 0.75 0.00 0.00 35 Y 7.30 4.10 0.00 2.40 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 4.89 0.00 2.21 2.08 0.00 3.96 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 37 W 7.89 4.34 0.00 3.57 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 38 T 7.50 4.28 4.41 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 0.97 0.00 0.00 39 Q 8.07 4.20 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 40 R 7.80 3.72 0.00 1.70 1.67 0.00 3.05 0.00 0.00 2.70 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.41 0.00 41 F 7.61 4.36 0.00 2.71 2.42 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 42 F 8.15 4.61 0.00 2.84 2.38 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 43 E 8.76 3.98 0.00 2.03 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 0.00 2.41 2.44 0.00 44 S 8.06 4.45 0.00 4.11 4.09 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 45 F 8.45 4.67 0.00 3.22 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 46 G 7.69 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 47 D 8.58 4.57 0.00 2.65 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.21 4.92 0.00 1.65 1.60 1.04 1.01 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 49 S 8.23 4.33 0.00 4.01 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 50 T 7.46 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 A 8.48 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 52 D 8.02 4.28 0.00 2.69 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 53 A 7.48 3.99 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 54 V 7.82 3.66 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 1.04 0.00 0.00 0.98 0.00 0.00 55 M 7.94 4.02 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.84 0.00 56 N 7.98 4.63 0.00 2.83 2.83 0.00 0.00 7.00 7.49 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 57 N 7.85 4.39 0.00 3.08 2.81 0.00 0.00 7.16 7.20 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 58 P 0.00 4.32 0.00 2.14 2.04 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 59 K 8.19 3.68 0.00 1.62 0.74 0.00 1.56 0.00 0.00 1.10 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.14 1.25 7.81 60 V 7.82 3.71 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 1.13 0.00 0.00 1.03 0.00 0.00 61 K 7.97 3.95 0.00 1.86 1.82 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 A 8.17 4.00 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 63 H 8.80 4.49 0.00 3.58 3.59 0.00 5.79 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 8.51 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 65 K 8.10 4.09 0.00 1.87 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.53 7.81 66 K 7.73 4.00 0.00 2.04 1.89 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.73 7.81 67 V 7.83 3.71 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 1.29 0.00 0.00 1.06 0.00 0.00 68 L 8.19 4.52 0.00 2.05 1.88 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.50 4.52 0.00 2.96 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 70 S 8.40 4.24 0.00 4.21 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 0.00 71 F 8.55 4.08 0.00 3.40 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 72 S 8.60 4.28 0.00 4.26 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 0.00 73 N 8.09 4.57 0.00 2.77 2.91 0.00 0.00 6.97 8.74 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 74 G 8.22 3.65 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 0.00 0.00 0.00 75 M 8.06 3.91 0.00 1.67 1.97 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 2.44 0.00 76 K 7.56 4.11 0.00 1.74 1.65 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.61 1.61 7.81 77 H 8.12 4.98 0.00 2.99 3.11 0.00 5.62 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 78 L 7.90 4.00 0.00 1.58 1.69 0.82 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.92 4.68 0.00 2.64 2.68 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 80 D 8.11 4.73 0.00 2.67 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 81 L 8.03 4.06 0.00 1.78 1.90 0.97 1.06 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 82 K 8.10 4.02 0.00 1.70 1.68 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 83 G 7.66 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.61 3.77 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 0.46 0.00 0.00 85 F 7.98 4.68 0.00 3.05 2.82 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 86 A 7.58 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 87 A 7.90 3.92 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 88 L 7.90 4.03 0.00 1.96 1.71 1.11 0.89 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 89 S 8.64 4.12 0.00 3.86 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 90 E 8.04 3.86 0.00 2.25 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 2.30 2.53 0.00 91 L 7.73 3.90 0.00 1.77 1.80 0.89 1.01 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 92 H 8.39 4.19 0.00 3.29 3.53 0.00 5.85 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.01 4.22 0.00 2.60 1.74 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 94 D 7.76 4.40 0.00 2.78 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 95 K 8.00 4.20 0.00 1.90 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.38 7.81 96 L 7.89 4.40 0.00 1.77 1.71 0.72 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.07 4.42 0.00 3.38 3.48 0.00 5.75 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.78 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 0.44 0.00 0.00 0.06 0.00 0.00 99 D 8.75 4.26 0.00 2.68 2.46 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 0.00 100 P 0.00 2.97 0.00 2.19 2.40 0.00 3.40 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.68 0.00 101 E 8.06 3.87 0.00 2.03 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 2.26 2.38 0.00 102 N 8.07 4.43 0.00 2.77 2.90 0.00 0.00 6.98 7.51 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 0.00 103 F 7.67 4.52 0.00 3.13 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 0.00 104 K 8.08 4.06 0.00 2.00 1.90 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.60 7.81 105 L 7.80 3.92 0.00 1.79 1.37 0.57 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.32 4.13 0.00 1.88 1.82 1.00 1.12 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 0.00 107 G 8.25 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.66 4.40 0.00 2.99 2.98 0.00 0.00 6.72 7.46 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 0.00 109 V 8.12 3.64 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.17 0.00 0.00 110 L 8.16 3.82 0.00 1.69 1.73 0.80 0.08 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 0.00 111 V 7.78 3.59 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 1.21 0.00 0.00 1.15 0.00 0.00 112 V 7.91 3.62 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 0.94 0.00 0.00 1.05 0.00 0.00 113 V 7.96 3.51 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 0.86 0.00 0.00 0.93 0.00 0.00 114 L 8.06 3.87 0.00 1.04 0.58 0.57 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.73 4.10 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 0.00 0.00 0.00 0.00 0.00 116 R 7.89 3.82 0.00 1.91 1.93 0.00 3.21 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 117 H 7.93 3.98 0.00 2.52 1.78 0.00 5.84 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.97 4.96 0.00 3.38 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.59 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 0.00 120 K 9.51 3.90 0.00 1.76 1.95 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 121 E 8.25 4.22 0.00 2.50 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 0.00 2.48 2.39 0.00 122 F 8.03 4.43 0.00 3.01 3.05 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 0.00 123 T 7.33 4.08 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 1.29 0.00 0.00 124 P 0.00 4.09 0.00 2.12 2.12 0.00 3.55 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 2.09 2.14 0.00 125 V 7.56 3.49 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 0.99 0.00 0.00 0.90 0.00 0.00 126 L 7.60 3.84 0.00 1.65 1.40 1.02 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.86 3.38 0.00 1.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 128 A 7.88 3.98 1.37 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 0.00 0.00 0.00 129 D 7.94 4.27 0.00 2.85 2.55 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 0.00 0.00 0.00 130 F 8.26 4.17 0.00 3.38 3.26 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 0.00 131 Q 8.35 4.13 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 132 K 7.91 4.06 0.00 1.95 1.84 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.58 7.81 133 V 7.47 3.61 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 1.14 0.00 0.00 0.80 0.00 0.00 134 V 8.31 3.89 2.26 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 1.08 0.00 0.00 1.11 0.00 0.00 135 A 8.31 4.13 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 8.20 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.16 3.20 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 -0.03 0.00 0.00 0.71 0.00 0.00 138 A 8.17 3.96 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 0.00 139 N 7.98 4.32 0.00 2.74 2.93 0.00 0.00 7.05 7.45 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 0.00 140 A 7.93 4.10 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 0.00 141 L 7.90 3.66 0.00 1.26 0.30 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.66 4.91 1.62 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 0.00 143 H 7.84 3.84 0.00 3.25 3.27 0.00 5.60 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.75 4.03 0.00 1.61 1.91 0.00 3.36 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 145 Y 7.94 4.50 0.00 3.32 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 0.00 146 H 7.99 4.31 0.00 3.27 3.19 0.00 5.70 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