NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6874 8.2893 120.3265 55.3429 33.5303 174.1387 2 D 4.8806 8.7312 121.5158 50.1433 42.6294 173.2053 3 E 4.0115 9.5424 119.0887 59.7097 30.0114 181.0347 4 I 3.7660 7.8434 119.4829 64.3416 37.2923 177.8803 5 D 4.3620 8.5305 119.8198 57.3771 40.5736 178.7880 6 L 4.0564 7.7846 119.0107 57.9516 41.1140 179.8800 7 R 3.9576 7.8327 118.0288 59.0920 29.9773 179.2477 8 I 3.5825 7.7003 119.6580 64.4705 37.2073 178.4646 9 L 4.0107 8.4321 120.1575 57.6674 41.2351 179.4423 10 K 4.0674 8.3387 118.6274 58.6138 32.2156 178.3178 11 I 4.2365 7.1310 119.6253 63.9970 37.4967 178.0239 12 L 4.2852 7.9060 118.2354 57.4474 41.4540 179.1934 13 Q 4.0263 8.0946 116.9930 58.4706 28.6228 177.3621 14 Y 4.5600 7.7226 117.2839 58.5030 38.9818 175.3576 15 N 4.6513 8.4684 120.1033 52.3690 40.3405 173.4115 16 A 4.4548 8.6371 127.8422 52.5482 19.1376 177.0025 17 K 4.3904 8.1969 116.8655 56.2956 32.1605 176.1089 18 Y 4.4146 7.7114 114.6128 57.2235 38.7921 175.6696 19 S 4.6338 8.3419 116.8982 57.5934 65.6524 175.4009 20 L 3.9726 8.5447 124.0376 58.2542 41.3817 179.7371 21 D 4.3113 8.0135 118.2661 57.4448 40.9990 178.4710 22 E 3.9769 8.0000 119.0650 59.2629 29.3513 179.5847 23 I 3.5018 7.9452 119.6956 64.4087 37.2721 178.3419 24 A 3.9506 8.5449 121.9839 55.1628 17.8759 179.5511 25 R 3.9275 7.8922 116.4934 59.0560 30.2094 177.8932 26 E 4.0684 7.7885 118.6994 58.5764 29.8083 177.9510 27 I 3.9466 7.8360 111.3137 60.5637 39.1771 175.2027 28 R 3.7850 8.2825 118.3094 56.4472 26.8833 175.3151 29 I 4.6292 7.1073 108.6562 58.2800 41.2623 173.3422 30 P 4.1899 0.0000 0.0000 62.9724 31.7371 177.2858 31 K 3.9119 8.9901 124.7674 59.7685 31.5924 178.6275 32 S 4.2079 8.0176 114.0742 61.4931 63.0679 176.5798 33 T 3.9924 8.3006 119.7713 66.2532 68.2334 176.2366 34 L 3.9133 8.0535 121.9135 58.6413 41.9358 178.8254 35 S 4.0884 7.9855 112.1667 61.4966 62.1681 175.5901 36 Y 4.0712 7.7309 121.9556 60.7829 38.5572 177.9078 37 R 3.6480 8.4529 119.3390 59.4196 30.3414 179.0880 38 I 3.6872 7.9850 119.6016 64.4094 37.2307 178.7079 39 K 4.4032 7.9647 120.6364 58.6473 31.7527 179.4059 40 K 3.7543 7.9211 120.3634 59.4574 32.1345 178.8235 41 L 3.9599 8.0679 119.5694 57.8324 41.3281 179.5334 42 E 4.2633 7.9262 119.3997 58.8645 29.2159 179.5713 43 K 4.0106 7.6430 116.9059 59.4663 32.2928 178.7460 44 D 4.5646 8.1940 116.7581 54.9415 40.7419 177.4482 45 G 3.9057 7.6018 107.7644 45.4772 0.0000 175.1125 46 V 3.5113 7.8370 119.7587 65.5322 31.6604 176.4915 47 I 4.0322 7.4017 124.4876 59.8253 36.7739 176.5349 48 K 3.9322 8.3884 125.8794 56.8225 32.4043 177.2608 49 G 3.7180 6.1679 105.7403 45.7129 0.0000 170.7986 50 Y 4.4985 8.1288 116.0162 56.1301 40.6637 175.0993 51 Y 5.1133 8.3219 120.5570 56.0585 41.6626 174.6763 52 A 4.3977 8.5569 125.1442 51.3280 19.8740 176.7663 53 Y 4.5468 8.5801 124.6103 56.6458 38.4238 174.4007 54 I 3.9648 7.8404 128.4884 59.3916 38.8269 175.4113 55 N 4.1075 8.1740 123.6544 52.5335 39.0840 173.3888 56 P 4.1934 0.0000 0.0000 65.8834 31.3338 178.3575 57 A 4.0179 8.0483 118.9053 55.2293 18.1365 179.6047 58 S 4.3679 7.9100 112.5472 60.6591 61.4615 175.2767 59 L 4.4891 7.6812 120.3622 53.8652 41.8456 176.4995 60 N 4.4040 8.5016 115.5445 54.3725 36.4344 174.4886 61 L 4.8171 7.1836 119.2271 54.3268 39.8817 175.8656 62 D 4.6509 8.3694 120.8068 54.2991 42.8788 175.3279 63 Y 4.3374 8.6969 120.7864 56.3272 39.5421 173.0397 64 I 4.8874 7.7596 126.0468 59.4727 39.7004 175.0104 65 V 4.8035 8.5111 119.1895 59.5291 36.3685 174.7702 66 I 4.9186 8.5236 123.3480 60.0246 40.4682 174.5028 67 T 5.1698 9.0811 124.5161 61.8252 71.6684 173.4459 68 S 5.1729 9.0843 122.6590 57.3163 65.0270 173.3228 69 V 4.8822 9.1278 124.5902 61.1259 34.4586 174.1073 70 K 4.9247 9.5539 127.5502 55.0109 34.0220 175.4997 71 A 5.2405 8.4834 125.9784 49.8944 21.2329 176.7104 72 K 4.3538 8.7755 120.0882 57.0554 33.5326 176.6280 73 Y 4.3496 8.7680 119.5511 58.2100 39.2967 174.6596 74 G 4.0168 9.8373 110.5808 45.1088 0.0000 178.8156 75 K 3.4441 7.8943 121.9490 55.4397 31.3223 175.0475 76 N 5.0453 7.9186 114.0335 53.9808 39.6768 175.4307 77 Y 4.3767 7.7263 116.4942 61.1566 38.0707 177.6541 78 H 4.1549 8.3883 116.4239 59.1811 28.7297 177.7589 79 V 3.6635 7.7627 119.1057 66.0502 31.5532 177.6863 80 E 3.9502 8.1407 118.1520 59.4117 29.3434 179.1060 81 L 3.9639 8.4099 120.8678 57.9043 42.1514 179.2154 82 G 2.9539 7.6954 105.3572 47.7539 0.0000 175.5020 83 N 4.4048 7.6036 117.9036 55.5735 38.4350 177.5190 84 K 4.0801 7.8149 119.9088 59.3581 31.9998 179.3928 85 L 3.8991 7.8069 119.1085 57.5927 41.2658 179.3381 86 A 4.0510 7.5930 119.4998 54.0804 18.3788 178.5299 87 Q 4.3866 7.3479 113.8142 55.3243 29.5715 175.8093 88 I 3.9856 7.1295 124.0283 60.3214 37.7754 173.8142 89 P 4.5364 0.0000 0.0000 64.3091 31.9240 176.0813 90 G 3.7680 9.1407 110.3217 45.2735 0.0000 173.1970 91 V 4.2895 7.5784 119.9532 62.1718 31.4457 175.2502 92 W 4.8117 8.5226 124.6506 56.4583 29.9383 176.4418 93 G 3.6908 7.0765 107.6220 44.1929 0.0000 171.8530 94 V 4.8616 7.4771 123.0379 61.4612 34.5238 173.6567 95 Y 5.0141 9.0771 124.7656 56.2614 42.3014 173.8719 96 F 4.9672 9.0819 125.0013 56.7074 41.1422 175.0910 97 V 4.4609 7.6013 118.4724 59.4279 35.7342 175.1676 98 L 4.5558 8.1092 122.1636 54.4179 42.3418 175.3521 99 G 4.1581 7.7609 112.3245 45.3804 0.0000 174.2713 100 D 4.4544 7.8382 121.1020 53.2708 42.4148 176.4576 101 N 4.4713 8.2371 115.8086 52.6393 36.2886 171.5376 102 D 4.5034 6.4089 117.1579 52.6048 43.5071 174.9981 103 F 5.4135 8.9515 116.3888 56.4533 41.9202 175.0157 104 I 4.9000 9.0162 124.0906 59.6805 39.5672 174.6084 105 V 4.7721 9.1784 128.0231 61.3732 33.9412 173.9715 106 M 4.7715 8.5326 128.0808 53.6825 33.7854 175.1639 107 A 5.1293 8.6098 123.9776 50.5878 23.6242 174.7881 108 R 4.9832 8.1868 117.0581 54.9401 34.1530 174.6523 109 Y 4.9358 8.8836 119.2782 56.3855 42.7614 176.4292 110 K 5.0147 9.5639 120.6714 59.1060 33.5871 177.2371 111 T 4.7809 7.7260 107.9582 58.9506 72.2488 174.4437 112 R 2.5100 8.2048 120.1845 59.0390 29.7654 177.7834 113 E 3.8581 7.9965 117.8381 59.5756 29.4513 178.8278 114 E 3.8537 7.8355 119.1044 59.1988 29.6399 178.5325 115 F 3.1277 8.0377 120.5399 61.2135 39.4193 176.9906 116 M 3.5605 8.1584 118.5024 58.2071 31.5710 178.4359 117 E 3.8933 7.9405 118.0542 59.3266 29.9633 178.5845 118 K 4.1058 7.9624 117.3280 58.3432 32.5198 177.6981 119 F 4.3687 7.6362 119.1218 59.7458 40.4176 177.4048 120 L 3.6478 6.8399 118.9092 58.1818 41.8498 178.7288 121 E 3.8976 8.0494 117.4695 59.3040 29.4619 179.1805 122 R 3.8760 7.5628 118.1719 59.3645 30.2601 178.6234 123 V 3.3539 7.4339 118.0832 66.1555 31.2714 177.8708 124 M 4.1408 8.1967 117.6774 57.3987 31.8292 177.7890 125 S 4.6173 7.3597 112.5635 57.5960 64.1068 174.0556 126 I 4.0030 7.1814 125.4871 59.9478 36.9262 174.7881 127 P 4.1989 0.0000 0.0000 65.7407 31.4920 177.7766 128 E 3.8247 7.9506 116.3351 58.0836 30.4015 177.0646 129 V 4.1323 7.4064 120.8570 62.7418 31.4241 175.4060 130 E 4.2612 9.3245 130.3940 58.8115 30.3631 176.4536 131 R 4.7695 7.6314 116.5704 55.3133 33.6083 173.3525 132 A 5.2240 8.5246 125.2819 50.3692 22.5955 175.4211 133 S 4.5596 9.3741 116.2424 56.9657 65.5209 172.6917 134 T 4.9122 8.7560 124.2979 62.4519 70.0812 174.2223 135 Q 4.5508 9.0820 125.9591 53.9784 31.0788 175.0300 136 V 3.8578 8.2227 125.1085 62.3099 32.3470 175.4545 137 V 3.8508 8.5727 129.5338 62.8232 31.4715 176.1172 138 V 4.1748 8.3502 120.0968 61.0499 32.8014 175.8431 139 K 4.2090 7.6357 119.8738 55.5942 34.6168 174.7661 140 I 4.2664 8.2032 128.1774 59.8012 36.6785 175.4731 141 I 3.9083 8.2516 127.3227 63.8009 37.3451 177.1552 142 K 4.5442 7.6263 118.0584 55.5375 34.7854 175.4179 143 E 4.6592 8.3423 125.9766 55.4109 31.0034 174.1718 144 S 4.6450 7.9002 122.1562 55.5591 63.4927 173.3875 145 P 4.3532 0.0000 0.0000 65.2751 31.7935 178.5217 146 N 4.1734 7.8704 115.6610 55.2153 37.2660 174.8762 147 I 3.7048 7.1612 119.5761 60.7573 36.0629 175.5613 148 V 4.1646 8.4931 119.2084 60.9258 33.0315 176.3900 149 I 4.3892 7.6462 119.8858 59.4739 38.1944 175.4268 150 F 4.2681 8.9505 123.3522 57.5849 38.9229 176.0398 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 4.69 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 2 D 8.73 4.88 0.00 2.85 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 3 E 9.54 4.01 0.00 2.03 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 2.41 2.42 0.00 4 I 7.84 3.77 2.11 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 1.65 0.82 0.92 0.00 0.00 5 D 8.53 4.36 0.00 2.84 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 6 L 7.78 4.06 0.00 1.86 1.73 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 7 R 7.83 3.96 0.00 1.91 1.96 0.00 3.29 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 8 I 7.70 3.58 2.04 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 1.52 1.14 0.93 0.00 0.00 9 L 8.43 4.01 0.00 1.76 1.69 0.90 0.68 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 10 K 8.34 4.07 0.00 1.89 2.00 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.55 7.81 11 I 7.13 4.24 2.06 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.74 0.89 0.00 0.00 12 L 7.91 4.29 0.00 1.68 1.87 1.04 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.09 4.03 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.35 1.84 0.00 14 Y 7.72 4.56 0.00 3.21 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 15 N 8.47 4.65 0.00 2.58 2.61 0.00 0.00 7.25 8.76 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 16 A 8.64 4.45 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 17 K 8.20 4.39 0.00 1.66 1.71 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.38 7.81 18 Y 7.71 4.41 0.00 3.05 2.78 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 19 S 8.34 4.63 0.00 4.11 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.54 3.97 0.00 1.72 1.78 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.01 4.31 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 22 E 8.00 3.98 0.00 2.13 1.94 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 2.35 2.39 0.00 23 I 7.95 3.50 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.79 0.86 0.00 0.00 24 A 8.54 3.95 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 25 R 7.89 3.93 0.00 1.94 2.12 0.00 3.24 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 26 E 7.79 4.07 0.00 2.00 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 2.19 2.28 0.00 27 I 7.84 3.95 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 1.78 0.73 0.87 0.00 0.00 28 R 8.28 3.78 0.00 2.01 2.08 0.00 3.29 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 29 I 7.11 4.63 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.53 0.96 0.00 0.00 30 P 0.00 4.19 0.00 2.21 2.06 0.00 3.63 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 2.09 0.00 31 K 8.99 3.91 0.00 1.82 1.84 0.00 1.72 0.00 0.00 2.06 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.69 7.81 32 S 8.02 4.21 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 33 T 8.30 3.99 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 1.30 0.00 0.00 34 L 8.05 3.91 0.00 1.76 1.89 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.99 4.09 0.00 4.09 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 36 Y 7.73 4.07 0.00 3.11 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.45 3.65 0.00 2.01 1.94 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 38 I 7.99 3.69 2.01 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 1.55 1.28 0.99 0.00 0.00 39 K 7.96 4.40 0.00 1.89 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.56 7.81 40 K 7.92 3.75 0.00 1.10 1.62 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.35 7.81 41 L 8.07 3.96 0.00 1.83 1.66 0.89 0.92 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 42 E 7.93 4.26 0.00 2.20 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 2.33 2.53 0.00 43 K 7.64 4.01 0.00 1.74 1.86 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.19 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.76 1.61 7.81 44 D 8.19 4.56 0.00 2.62 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 45 G 7.60 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 46 V 7.84 3.51 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.90 0.00 0.00 47 I 7.40 4.03 1.73 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 1.27 0.46 0.37 0.00 0.00 48 K 8.39 3.93 0.00 1.63 1.81 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.38 7.81 49 G 6.17 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 8.13 4.50 0.00 2.95 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 51 Y 8.32 5.11 0.00 2.92 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 52 A 8.56 4.40 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 53 Y 8.58 4.55 0.00 2.84 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 54 I 7.84 3.96 1.75 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 1.22 0.80 0.80 0.00 0.00 55 N 8.17 4.11 0.00 2.55 2.55 0.00 0.00 7.20 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.19 0.00 2.16 2.07 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 2.08 2.09 0.00 57 A 8.05 4.02 1.29 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 58 S 7.91 4.37 0.00 3.95 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 59 L 7.68 4.49 0.00 1.81 1.63 0.87 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.50 4.40 0.00 2.92 2.92 0.00 0.00 7.04 6.68 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 61 L 7.18 4.82 0.00 1.77 1.65 0.89 0.92 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 62 D 8.37 4.65 0.00 2.87 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 63 Y 8.70 4.34 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 64 I 7.76 4.89 1.82 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 1.33 0.74 1.02 0.00 0.00 65 V 8.51 4.80 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 0.26 0.00 0.00 0.86 0.00 0.00 66 I 8.52 4.92 1.84 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 1.20 0.63 0.89 0.00 0.00 67 T 9.08 5.17 4.49 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 1.46 0.00 0.00 68 S 9.08 5.17 0.00 3.80 3.97 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 69 V 9.13 4.88 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 1.12 0.00 0.00 1.04 0.00 0.00 70 K 9.55 4.92 0.00 1.77 1.79 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 71 A 8.48 5.24 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.78 4.35 0.00 1.87 1.87 0.00 1.19 0.00 0.00 0.77 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.02 1.50 7.81 73 Y 8.77 4.35 0.00 3.05 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 74 G 9.84 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.89 3.44 0.00 1.86 0.74 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 0.97 7.81 76 N 7.92 5.05 0.00 2.63 2.83 0.00 0.00 6.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.73 4.38 0.00 3.20 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 78 H 8.39 4.15 0.00 3.10 3.22 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.76 3.66 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 1.07 0.00 0.00 0.89 0.00 0.00 80 E 8.14 3.95 0.00 2.37 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 2.37 0.00 81 L 8.41 3.96 0.00 1.75 1.79 0.79 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.70 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 0.00 0.00 0.00 83 N 7.60 4.40 0.00 2.61 2.85 0.00 0.00 7.13 7.50 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 84 K 7.81 4.08 0.00 1.87 1.76 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.69 7.81 85 L 7.81 3.90 0.00 1.64 1.62 0.60 0.70 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 86 A 7.59 4.05 1.29 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 87 Q 7.35 4.39 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 88 I 7.13 3.99 2.09 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.75 1.08 0.00 0.00 89 P 0.00 4.54 0.00 2.17 2.07 0.00 3.72 0.00 0.00 3.83 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 90 G 9.14 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 91 V 7.58 4.29 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 0.85 0.00 0.00 1.25 0.00 0.00 92 W 8.52 4.81 0.00 3.39 3.12 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 93 G 7.08 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 94 V 7.48 4.86 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 0.87 0.00 0.00 0.83 0.00 0.00 95 Y 9.08 5.01 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 F 9.08 4.97 0.00 2.90 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 97 V 7.60 4.46 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 0.58 0.00 0.00 0.76 0.00 0.00 98 L 8.11 4.56 0.00 1.59 1.56 0.94 1.05 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 99 G 7.76 4.16 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 0.00 100 D 7.84 4.45 0.00 2.71 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 0.00 101 N 8.24 4.47 0.00 2.85 3.01 0.00 0.00 7.04 8.06 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 0.00 102 D 6.41 4.50 0.00 2.98 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 0.00 103 F 8.95 5.41 0.00 3.17 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 9.02 4.90 2.04 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 1.11 0.93 0.94 0.00 0.00 105 V 9.18 4.77 2.25 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 1.19 0.00 0.00 1.04 0.00 0.00 106 M 8.53 4.77 0.00 0.95 0.57 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.29 0.00 107 A 8.61 5.13 1.08 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 0.00 0.00 108 R 8.19 4.98 0.00 1.57 1.76 0.00 3.10 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 109 Y 8.88 4.94 0.00 3.11 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 0.00 110 K 9.56 5.01 0.00 1.84 1.93 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.72 1.30 7.81 111 T 7.73 4.78 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 112 R 8.20 2.51 0.00 1.33 1.73 0.00 3.22 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 113 E 8.00 3.86 0.00 2.05 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 2.38 2.40 0.00 114 E 7.84 3.85 0.00 2.02 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 2.56 2.41 0.00 115 F 8.04 3.13 0.00 3.13 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 M 8.16 3.56 0.00 1.92 2.13 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.96 0.00 117 E 7.94 3.89 0.00 1.86 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 2.29 0.00 118 K 7.96 4.11 0.00 1.66 1.93 0.00 1.93 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.49 7.81 119 F 7.64 4.37 0.00 2.96 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 0.00 120 L 6.84 3.65 0.00 0.98 1.27 1.02 1.00 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 0.00 121 E 8.05 3.90 0.00 1.85 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 0.00 2.26 2.29 0.00 122 R 7.56 3.88 0.00 1.72 1.84 0.00 3.10 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 123 V 7.43 3.35 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.08 0.00 0.00 124 M 8.20 4.14 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.50 0.00 125 S 7.36 4.62 0.00 3.92 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 7.18 4.00 1.88 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.19 0.90 0.00 0.00 127 P 0.00 4.20 0.00 1.93 2.04 0.00 3.61 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 1.98 2.06 0.00 128 E 7.95 3.82 0.00 1.88 1.86 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 2.43 2.11 0.00 129 V 7.41 4.13 2.18 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 0.69 0.00 0.00 0.89 0.00 0.00 130 E 9.32 4.26 0.00 2.01 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 2.38 2.34 0.00 131 R 7.63 4.77 0.00 1.93 1.74 0.00 3.21 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 132 A 8.52 5.22 1.24 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 0.00 0.00 133 S 9.37 4.56 0.00 3.88 3.73 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 0.00 134 T 8.76 4.91 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 1.19 0.00 0.00 135 Q 9.08 4.55 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 136 V 8.22 3.86 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 0.28 0.00 0.00 0.68 0.00 0.00 137 V 8.57 3.85 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 0.80 0.00 0.00 0.90 0.00 0.00 138 V 8.35 4.17 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 0.67 0.00 0.00 0.89 0.00 0.00 139 K 7.64 4.21 0.00 1.66 1.63 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.44 7.81 140 I 8.20 4.27 1.89 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 1.44 0.72 0.95 0.00 0.00 141 I 8.25 3.91 1.89 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 1.31 0.74 0.93 0.00 0.00 142 K 7.63 4.54 0.00 1.70 1.65 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.45 7.81 143 E 8.34 4.66 0.00 1.94 1.79 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 2.10 2.35 0.00 144 S 7.90 4.64 0.00 3.79 3.54 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 0.00 145 P 0.00 4.35 0.00 2.17 2.20 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.76 0.00 146 N 7.87 4.17 0.00 2.65 2.83 0.00 0.00 6.08 7.81 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 0.00 147 I 7.16 3.70 1.39 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 0.90 0.37 -0.02 0.00 0.00 148 V 8.49 4.16 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 0.66 0.00 0.00 0.91 0.00 0.00 149 I 7.65 4.39 1.83 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 1.42 0.56 0.94 0.00 0.00 150 F 8.95 4.27 0.00 3.03 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