NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2616 8.2649 123.5787 52.2481 19.9431 176.4246 2 C 4.6302 8.3304 116.8812 54.9580 41.6869 172.1658 3 D 4.4086 9.7339 126.4750 57.2343 42.4103 175.8987 4 Y 5.1056 8.6210 115.5238 56.4507 42.2925 174.4567 5 T 5.0238 8.3697 122.3934 62.2148 71.5420 172.9984 6 C 4.7795 9.1260 126.1630 55.6117 41.6774 176.0191 7 G 3.9495 9.2943 118.0764 46.0792 0.0000 172.7198 8 S 4.6267 8.9481 116.5524 57.6725 65.9091 173.9039 9 N 4.2222 8.3903 120.2144 52.7644 38.8499 173.0987 10 C 4.6337 8.2468 123.5358 55.4445 40.3705 171.9154 11 Y 5.0880 8.9969 125.2354 56.3932 40.2833 175.2985 12 S 5.7241 9.2899 119.6648 55.9438 65.5133 175.5207 13 S 4.2453 9.3128 118.1916 62.1803 62.4097 177.3712 14 S 4.1269 8.0821 118.1000 61.5627 62.6322 176.1869 15 D 4.5017 8.7366 123.2616 56.7833 40.6640 178.7726 16 V 3.5471 7.9262 118.5504 66.0988 31.4827 178.0793 17 S 4.1237 8.3908 114.3120 61.7494 62.6293 176.6008 18 T 3.8975 7.9545 113.1196 64.0348 68.4345 176.5180 19 A 4.2300 8.0863 123.9061 54.9847 18.5124 179.0711 20 Q 3.8462 8.1020 117.9357 59.3386 29.0191 178.3755 21 A 3.8180 7.9183 121.2444 55.3167 18.4963 179.3187 22 A 3.9012 7.5269 117.6704 55.2173 18.3466 180.1448 23 G 2.0969 7.1581 103.8729 47.5613 0.0000 175.3732 24 Y 3.3677 7.7524 122.7490 59.5926 38.6611 177.6650 25 K 3.6223 8.0893 121.0710 59.6216 32.1872 178.6042 26 L 3.8379 7.3667 118.3493 58.0221 41.3308 178.8906 27 H 3.8847 7.8126 117.0331 59.1911 29.7304 176.5754 28 E 3.6209 7.6709 120.1080 59.3465 29.5668 178.3796 29 D 4.4175 7.5398 117.5095 55.3856 40.8462 177.6825 30 G 3.8626 8.1684 107.0048 44.9398 0.0000 172.7031 31 E 4.5483 7.6299 116.9102 54.7781 31.2358 175.2387 32 T 5.0558 8.2019 109.9938 60.1262 72.1810 172.9897 33 V 4.4886 8.9738 114.5124 60.7195 35.8682 176.3649 34 G 4.7978 8.9769 106.9183 46.3560 0.0000 174.6800 35 S 4.3156 8.5668 112.4552 60.4418 63.3708 174.8166 36 N 4.5104 8.0845 116.1500 52.2516 38.5946 174.6700 37 S 3.7883 7.2146 114.4108 59.3673 60.2337 170.1784 38 Y 5.0842 9.1602 120.7404 55.7479 40.1960 173.7009 39 P 5.6288 0.0000 0.0000 62.4984 32.9828 174.8450 40 H 5.2009 8.5596 115.0366 53.6491 32.4001 172.1217 41 E 4.5076 9.2453 118.6207 57.5199 30.1257 176.6108 42 F 4.7516 8.6348 125.6351 56.5092 41.3017 174.9194 43 R 4.0979 7.8528 126.4024 54.9998 30.9053 177.8976 44 N 4.2583 8.3402 125.2195 52.7310 37.0372 175.4270 45 W 4.4142 7.4786 120.4366 59.8782 29.8720 178.1369 46 Q 3.8941 8.0215 115.4082 56.1271 28.9141 175.2008 47 G 3.6357 7.4442 106.6890 46.0614 0.0000 173.3581 48 F 4.3992 7.9732 118.3626 56.9346 40.3705 176.9842 49 D 4.5853 8.2210 123.4879 53.5732 39.2357 174.1929 50 F 5.1817 7.8438 120.5377 55.7379 40.8162 176.5249 51 S 4.3248 9.0080 121.7507 61.6015 62.9443 175.4203 52 V 4.1152 7.5853 111.3872 60.5463 32.4871 175.6062 53 S 4.5626 8.1556 117.5630 57.4454 63.9857 174.3144 54 S 3.3519 7.7807 118.3309 56.8994 63.5297 172.4067 55 P 4.1843 0.0000 0.0000 63.1207 32.6121 174.9596 56 Y 5.0690 7.7956 117.6169 56.7735 41.6821 174.2199 57 Y 5.1646 8.1416 117.5208 56.5473 42.4869 173.9626 58 E 4.2792 9.0892 125.5126 54.9853 31.4582 174.8460 59 W 5.1794 8.4291 135.0000 55.0770 34.4899 172.2200 60 P 4.2241 0.0000 0.0000 62.2526 31.5550 175.7843 61 I 4.2211 7.5696 123.8371 58.7817 39.3120 175.2518 62 L 4.2504 8.4364 129.7974 54.5707 42.3083 178.1372 63 S 4.5783 8.9510 115.8185 60.6234 63.4192 175.6932 64 S 4.5970 8.2522 113.9496 57.6733 62.5348 173.7680 65 G 4.0954 7.7705 107.2244 47.1850 0.0000 173.0128 66 D 5.0088 8.0235 116.0146 51.7202 44.3092 174.9809 67 V 4.2060 8.1186 115.4584 59.9479 32.7631 175.9254 68 Y 4.0891 8.7873 126.0072 58.1891 38.8767 176.4802 69 S 4.4950 8.9600 119.1735 57.2152 64.8375 174.0463 70 G 3.7904 6.1842 117.8954 45.4467 0.0000 174.3764 71 G 3.9736 6.8254 115.4129 45.4563 0.0000 173.9012 72 S 4.4145 8.6860 120.6122 57.5894 63.2765 172.5794 73 P 3.8758 0.0000 0.0000 63.6359 31.5476 177.4428 74 G 3.6994 8.0752 105.1373 44.4057 0.0000 171.7529 75 A 4.6759 8.3884 117.8134 52.0819 21.2897 176.7194 76 D 5.2186 7.9329 115.9534 53.0634 43.0986 175.8698 77 R 4.7659 9.1704 120.9039 54.2583 34.9507 174.2203 78 V 4.2755 8.8938 122.8589 61.0830 33.9767 174.3214 79 V 4.8879 8.5231 128.6098 60.3377 33.2337 174.4922 80 F 5.5180 7.8496 121.8227 55.1488 42.1562 173.2012 81 N 5.7924 8.8078 116.7939 49.9968 40.0216 174.8390 82 E 4.5051 9.2009 118.6559 59.1900 29.5365 177.0206 83 N 4.6557 8.4040 113.3921 52.4539 38.9917 173.8602 84 N 3.7224 8.2546 116.0246 54.7381 37.7144 173.6555 85 Q 4.5485 8.1849 114.8562 53.3988 31.0646 175.1952 86 L 4.3698 8.3638 123.7156 54.8032 42.4725 176.3158 87 A 3.9958 8.7251 130.3229 52.3416 19.2579 177.1555 88 G 3.9825 6.2486 103.4044 46.3056 0.0000 171.7770 89 V 4.5682 7.1706 119.8188 60.8141 33.6311 174.3147 90 I 4.8713 7.9481 121.0761 59.4552 41.2012 174.2130 91 T 5.1862 8.5805 115.9325 61.2184 70.6912 174.5133 92 H 4.3616 9.3865 124.1755 58.1787 29.0424 175.3192 93 T 3.9166 7.4378 115.9137 66.6860 68.1475 174.1395 94 G 3.9185 9.1890 115.1844 44.8969 0.0000 172.3735 95 A 4.6265 8.0324 122.3767 50.7745 20.8425 176.8318 96 S 4.6063 8.4678 115.4820 58.6773 65.1403 175.5465 97 G 3.7795 8.1096 112.7373 47.2667 0.0000 173.6237 98 N 4.6194 8.6450 116.8123 53.5982 39.2667 173.8676 99 N 4.9276 7.8329 114.1699 51.4030 41.1988 173.3824 100 F 5.4151 8.9336 117.6659 56.0659 43.0114 175.5819 101 V 4.7882 8.6652 118.5352 60.2363 34.7655 174.2149 102 E 4.0798 8.9003 124.4150 56.5981 29.6958 177.7176 103 C 4.6468 8.7340 122.7975 56.8225 41.3119 174.1392 104 T 4.1328 8.1632 110.6095 62.1222 68.4823 174.4184 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 A 8.26 4.26 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 8.33 4.63 0.00 3.04 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 3 D 9.73 4.41 0.00 2.71 2.32 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 4 Y 8.62 5.11 0.00 2.95 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 5 T 8.37 5.02 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 6 C 9.13 4.78 0.00 3.19 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 7 G 9.29 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 8 S 8.95 4.63 0.00 3.80 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.39 4.22 0.00 2.76 1.94 0.00 0.00 6.44 8.34 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 10 C 8.25 4.63 0.00 2.87 2.87 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 0.00 0.00 0.00 11 Y 9.00 5.09 0.00 3.18 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 12 S 9.29 5.72 0.00 3.97 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 13 S 9.31 4.25 0.00 4.08 4.20 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 0.00 0.00 0.00 14 S 8.08 4.13 0.00 3.93 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 15 D 8.74 4.50 0.00 2.91 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 7.93 3.55 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 1.05 0.00 0.00 1.05 0.00 0.00 17 S 8.39 4.12 0.00 4.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.95 3.90 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 19 A 8.09 4.23 1.52 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 20 Q 8.10 3.85 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.04 2.38 0.00 21 A 7.92 3.82 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 22 A 7.53 3.90 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 23 G 7.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.75 3.37 0.00 2.32 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.09 3.62 0.00 1.79 1.82 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.41 7.81 26 L 7.37 3.84 0.00 1.76 1.93 0.85 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 27 H 7.81 3.88 0.00 3.04 3.08 0.00 5.95 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.67 3.62 0.00 1.32 1.78 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 2.17 2.16 0.00 29 D 7.54 4.42 0.00 2.74 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 30 G 8.17 3.86 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 0.00 0.00 0.00 31 E 7.63 4.55 0.00 2.09 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 2.23 2.25 0.00 32 T 8.20 5.06 4.34 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 1.34 0.00 0.00 33 V 8.97 4.49 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 0.92 0.00 0.00 1.41 0.00 0.00 34 G 8.98 4.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.57 4.32 0.00 4.02 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 36 N 8.08 4.51 0.00 2.21 2.41 0.00 0.00 6.95 7.57 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 37 S 7.21 3.79 0.00 4.01 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 9.16 5.08 0.00 3.11 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 39 P 0.00 5.63 0.00 2.25 2.47 0.00 3.53 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 40 H 8.56 5.20 0.00 3.26 3.64 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 E 9.25 4.51 0.00 2.01 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 2.60 2.69 0.00 42 F 8.63 4.75 0.00 2.82 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.85 4.10 0.00 1.22 1.91 0.00 3.61 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 44 N 8.34 4.26 0.00 2.97 2.82 0.00 0.00 7.17 7.95 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 45 W 7.48 4.41 0.00 3.32 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Q 8.02 3.89 0.00 1.45 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 47 G 7.44 3.64 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 0.00 0.00 0.00 48 F 7.97 4.40 0.00 1.93 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 0.00 0.00 0.00 49 D 8.22 4.59 0.00 2.62 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 50 F 7.84 5.18 0.00 3.19 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 9.01 4.32 0.00 3.94 3.99 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 0.00 0.00 0.00 52 V 7.59 4.12 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 0.74 0.00 0.00 1.02 0.00 0.00 53 S 8.16 4.56 0.00 3.83 3.74 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 54 S 7.78 3.35 0.00 3.60 3.40 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 55 P 0.00 4.18 0.00 1.75 2.06 0.00 3.63 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 56 Y 7.80 5.07 0.00 3.17 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 57 Y 8.14 5.16 0.00 1.78 2.39 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 58 E 9.09 4.28 0.00 1.88 1.70 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 2.11 1.83 0.00 59 W 8.43 5.18 0.00 3.51 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 60 P 0.00 4.22 0.00 0.68 1.20 0.00 2.20 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.57 4.22 1.63 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.70 0.43 0.00 0.00 62 L 8.44 4.25 0.00 1.86 1.64 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.95 4.58 0.00 4.07 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 64 S 8.25 4.60 0.00 4.03 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 65 G 7.77 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.02 5.01 0.00 2.75 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 67 V 8.12 4.21 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 0.83 0.00 0.00 1.01 0.00 0.00 68 Y 8.79 4.09 0.00 2.60 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 0.00 0.00 0.00 0.00 69 S 8.96 4.50 0.00 3.87 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 6.18 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 71 G 6.83 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 0.00 0.00 0.00 72 S 8.69 4.41 0.00 3.92 3.87 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 0.00 0.00 0.00 73 P 0.00 3.88 0.00 1.79 1.64 0.00 3.85 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 74 G 8.08 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 75 A 8.39 4.68 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 76 D 7.93 5.22 0.00 2.73 2.50 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 77 R 9.17 4.77 0.00 1.15 1.34 0.00 2.99 0.00 0.00 2.71 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 78 V 8.89 4.28 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 0.95 0.00 0.00 0.79 0.00 0.00 79 V 8.52 4.89 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 0.40 0.00 0.00 -0.08 0.00 0.00 80 F 7.85 5.52 0.00 3.15 3.07 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 81 N 8.81 5.79 0.00 2.99 3.12 0.00 0.00 6.51 7.09 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 82 E 9.20 4.51 0.00 2.15 2.16 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 2.47 2.57 0.00 83 N 8.40 4.66 0.00 2.98 2.78 0.00 0.00 6.89 8.00 0.00 0.00 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 N 8.25 3.72 0.00 1.44 2.33 0.00 0.00 6.98 6.95 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 85 Q 8.18 4.55 0.00 2.32 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 86 L 8.36 4.37 0.00 1.77 1.57 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.73 4.00 0.32 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 88 G 6.25 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 89 V 7.17 4.57 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 0.84 0.00 0.00 0.21 0.00 0.00 90 I 7.95 4.87 1.59 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.18 0.27 0.00 0.00 91 T 8.58 5.19 4.35 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 1.33 0.00 0.00 92 H 9.39 4.36 0.00 3.15 3.20 0.00 5.71 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 T 7.44 3.92 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 94 G 9.19 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.03 4.63 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 96 S 8.47 4.61 0.00 3.91 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 97 G 8.11 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 98 N 8.65 4.62 0.00 2.65 2.82 0.00 0.00 6.71 7.79 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 99 N 7.83 4.93 0.00 2.96 2.82 0.00 0.00 6.84 8.18 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 0.00 100 F 8.93 5.42 0.00 3.36 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 0.00 101 V 8.67 4.79 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 0.87 0.00 0.00 1.02 0.00 0.00 102 E 8.90 4.08 0.00 1.82 1.82 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 1.47 1.92 0.00 103 C 8.73 4.65 0.00 2.91 3.18 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 0.00 104 T 8.16 4.13 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00