NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1482 8.1585 120.2739 55.0488 33.9436 176.9898 2 A 3.8564 7.6476 123.3881 54.5024 19.3883 177.0331 3 E 3.9378 8.4016 114.7594 59.7801 30.3311 178.4344 4 V 3.5613 7.6090 117.4841 65.9107 31.7809 177.3881 5 E 3.8847 8.0960 118.9909 58.9458 28.7118 178.3193 6 E 4.0511 8.0034 119.1639 59.0542 29.7860 177.8569 7 T 4.0597 7.6643 113.2881 64.9920 68.7440 175.1958 8 L 4.3531 7.8526 122.4109 56.8273 42.7586 178.0120 9 K 3.8377 8.0759 118.4812 59.6628 32.3279 179.1971 10 R 4.0369 7.6177 117.2323 59.3151 29.9776 178.9368 11 L 3.9574 7.8878 118.1200 57.9511 41.4454 179.2139 12 Q 3.8948 7.9277 116.9431 59.3946 28.6873 179.5432 13 S 4.2204 7.9612 113.0590 60.4007 62.7259 174.2853 14 Q 3.9683 7.2555 119.3378 55.5484 29.5210 176.3504 15 K 4.0206 8.2584 118.6941 56.9369 32.3436 179.4796 16 G 4.1333 8.6007 111.3750 48.5627 0.0000 173.6138 17 V 3.9385 7.2445 118.7614 62.6023 31.1434 175.7190 18 Q 4.4488 8.5131 123.4148 56.2708 30.6799 175.1810 19 G 4.1741 7.4689 103.0434 46.0539 0.0000 171.7654 20 I 5.1274 8.0783 119.2551 60.4387 42.6395 174.5059 21 I 4.8183 8.4253 122.8995 60.1592 41.9971 174.2787 22 V 4.9620 8.4432 126.0912 61.1033 34.2390 174.7589 23 V 5.0072 8.7776 126.1224 59.5340 35.1042 174.4680 24 N 4.6708 8.5388 118.6104 53.1397 38.4828 175.9166 25 T 4.3004 7.8303 101.4149 62.7454 69.8974 176.8958 26 E 3.6812 7.9172 121.7203 57.4666 29.7645 177.1512 27 G 4.0712 7.4374 105.0644 45.1410 0.0000 173.4759 28 I 4.1204 7.5451 121.9551 59.7184 37.9458 174.2222 29 P 4.8312 0.0000 0.0000 61.7291 28.5680 175.7321 30 I 3.4995 7.2989 124.3873 64.7578 37.2058 176.7705 31 K 4.5742 8.2657 119.6427 55.5782 35.3848 175.6167 32 S 4.3778 8.2311 114.0034 58.1130 63.9888 174.7398 33 T 4.5380 8.7109 126.9543 64.2799 68.9018 174.4455 34 M 4.8252 7.5976 121.8406 54.4333 35.4835 173.8475 35 D 4.6845 8.6560 119.5417 55.6396 41.2221 175.6700 36 N 4.5163 8.8234 116.3186 56.3474 38.9453 175.3927 37 P 4.5679 0.0000 0.0000 64.6612 32.0196 177.4642 38 T 3.8752 8.1218 115.5418 67.2449 68.1869 176.0930 39 T 4.0639 7.9075 116.9992 66.9395 68.5940 176.7476 40 T 3.9129 8.0395 117.7271 66.7369 68.3587 176.7441 41 Q 3.9114 7.8990 119.3617 59.0849 28.5660 177.3733 42 Y 4.5859 7.9253 115.1503 58.9120 37.8519 176.5904 43 A 4.6533 8.0949 121.6120 52.3835 20.3080 178.1333 44 S 4.6334 7.8826 110.4563 58.5771 64.4309 175.1577 45 L 4.5117 7.6468 123.2439 57.1072 42.7935 177.8600 46 M 4.4102 7.7271 118.3115 57.9687 31.5875 177.9900 47 H 4.4628 8.2874 118.1758 58.7668 29.9805 176.4756 48 S 4.3643 8.0575 115.4061 60.6247 63.3098 176.1073 49 F 4.2153 8.3367 124.5160 61.2206 39.2058 177.1020 50 I 3.8541 7.7958 118.8036 63.4542 37.0140 178.0715 51 L 3.9667 7.5642 121.0649 57.9090 41.7060 178.8203 52 K 3.9524 7.5970 116.8736 58.9045 32.1602 178.6669 53 A 4.2716 7.8637 120.4635 54.7609 18.0796 179.0658 54 R 3.7732 7.8654 117.0497 59.7922 29.8724 178.5914 55 S 4.4509 7.9549 114.2403 61.2923 63.0645 176.5098 56 T 3.8039 7.9733 118.6576 66.6220 68.2719 176.6948 57 V 3.5617 7.8680 120.5631 65.1890 30.7967 178.1450 58 R 3.8848 7.2066 118.0982 59.2043 30.0532 177.2545 59 D 4.4240 7.6795 116.1819 58.1236 41.1897 178.3132 60 I 4.0166 7.7182 119.6923 63.2323 37.4804 175.7297 61 D 4.2896 7.5967 113.9141 52.8717 43.7151 174.5959 62 P 4.4366 0.0000 0.0000 64.8555 31.5804 177.3626 63 Q 4.1434 7.9529 117.0079 57.2027 29.6606 175.7122 64 N 4.7857 7.4141 117.6157 51.7186 37.6956 173.0467 65 D 4.4747 7.5920 120.3069 54.0256 42.1540 176.7954 66 L 4.3133 7.9268 121.9382 55.8537 43.6629 174.1588 67 T 4.0656 7.9589 106.3623 62.3325 75.0500 172.9746 68 F 5.0407 7.4142 117.4243 56.0378 43.7147 172.9259 69 L 4.9201 8.4448 118.8772 53.1187 46.5956 175.5724 70 R 4.7569 7.6334 115.7357 56.3169 32.6891 173.3274 71 I 4.6594 8.0324 126.7221 59.3547 41.7010 174.7993 72 R 4.5535 8.4182 123.5955 54.7753 32.5642 174.6376 73 S 4.7609 8.4209 126.5785 58.5697 61.5268 175.2306 74 K 4.2820 8.6805 114.6255 58.3081 32.6188 178.0860 75 K 4.2170 7.8804 117.2606 58.4566 33.0482 177.0245 76 N 4.7784 7.5511 116.7904 51.7856 39.2516 171.9673 77 E 5.0127 8.7414 114.6949 55.0788 33.2571 175.0415 78 I 5.1213 8.2132 124.1837 59.6223 38.7607 174.7498 79 M 4.6164 8.3229 127.2872 55.1031 34.2630 174.9947 80 V 4.9327 8.1603 115.8321 60.1148 37.6997 173.9502 81 A 4.8514 8.2195 117.2584 51.0722 21.5150 173.7311 82 P 4.9568 0.0000 0.0000 63.3862 31.8226 176.1930 83 D 4.9209 9.1136 130.7007 53.6770 42.4516 176.0415 84 K 4.1429 9.0968 119.7437 60.6162 31.7230 177.2173 85 D 4.8049 8.1550 112.6637 53.7813 44.7781 173.7282 86 Y 4.5502 8.1327 117.4643 56.1067 40.5839 174.8444 87 F 5.6024 7.6052 123.1073 56.3865 41.7527 175.1842 88 L 5.3868 8.2911 120.7249 53.3806 44.8580 175.6571 89 I 4.8979 8.3516 118.7629 60.2101 41.7936 174.9980 90 V 4.6999 8.4681 123.8430 61.6725 35.6528 173.9801 91 I 4.8533 8.2498 125.6850 59.2834 38.1714 173.1783 92 Q 5.3511 8.5209 123.5426 53.1421 31.8792 174.6146 93 N 4.9817 8.3757 120.2535 51.4843 40.3405 174.6176 94 P 4.6362 0.0000 0.0000 64.0415 33.2436 175.3501 95 T 3.4213 8.5817 108.6410 64.2997 65.9277 171.7591 96 E 4.1046 8.2285 121.8324 57.0213 29.1895 177.3622 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 8.16 4.15 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 2 A 7.65 3.86 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 E 8.40 3.94 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 4 V 7.61 3.56 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 1.07 0.00 0.00 1.01 0.00 0.00 5 E 8.10 3.88 0.00 2.25 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 2.29 2.38 0.00 6 E 8.00 4.05 0.00 2.11 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 2.25 2.41 0.00 7 T 7.66 4.06 4.36 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 1.16 0.00 0.00 8 L 7.85 4.35 0.00 1.97 1.59 0.93 0.44 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 9 K 8.08 3.84 0.00 1.83 1.88 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.73 7.81 10 R 7.62 4.04 0.00 1.94 1.93 0.00 3.08 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.94 0.00 11 L 7.89 3.96 0.00 1.74 1.68 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 7.93 3.89 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 13 S 7.96 4.22 0.00 3.91 3.88 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 14 Q 7.26 3.97 0.00 2.28 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 15 K 8.26 4.02 0.00 1.80 1.63 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.41 7.81 16 G 8.60 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.24 3.94 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 0.79 0.00 0.00 0.92 0.00 0.00 18 Q 8.51 4.45 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 19 G 7.47 4.17 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 0.00 0.00 0.00 20 I 8.08 5.13 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.50 0.93 0.00 0.00 21 I 8.43 4.82 1.92 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.88 1.02 0.00 0.00 22 V 8.44 4.96 2.17 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 1.11 0.00 0.00 0.94 0.00 0.00 23 V 8.78 5.01 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 0.88 0.00 0.00 0.80 0.00 0.00 24 N 8.54 4.67 0.00 2.55 2.25 0.00 0.00 6.99 7.29 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 25 T 7.83 4.30 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 1.22 0.00 0.00 26 E 7.92 3.68 0.00 1.91 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 2.29 2.24 0.00 27 G 7.44 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 0.00 0.00 0.00 28 I 7.55 4.12 1.84 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 1.45 1.11 0.91 0.00 0.00 29 P 0.00 4.83 0.00 2.21 2.13 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 30 I 7.30 3.50 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.85 0.93 0.00 0.00 31 K 8.27 4.57 0.00 1.65 1.74 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.50 7.81 32 S 8.23 4.38 0.00 3.85 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 33 T 8.71 4.54 4.32 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 1.21 0.00 0.00 34 M 7.60 4.83 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 35 D 8.66 4.68 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 36 N 8.82 4.52 0.00 2.71 2.87 0.00 0.00 6.76 8.02 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 37 P 0.00 4.57 0.00 2.25 2.29 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 38 T 8.12 3.88 4.39 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 1.45 0.00 0.00 39 T 7.91 4.06 4.29 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 1.31 0.00 0.00 40 T 8.04 3.91 4.44 0.00 0.00 0.00 0.00 0.00 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 41 Q 7.90 3.91 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.56 2.28 0.00 42 Y 7.93 4.59 0.00 3.27 2.97 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 43 A 8.09 4.65 1.45 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 0.00 0.00 0.00 44 S 7.88 4.63 0.00 4.02 4.19 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 45 L 7.65 4.51 0.00 1.86 1.77 0.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 M 7.73 4.41 0.00 2.35 2.47 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 3.02 0.00 47 H 8.29 4.46 0.00 3.23 3.38 0.00 5.74 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 48 S 8.06 4.36 0.00 4.05 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 49 F 8.34 4.22 0.00 3.37 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 50 I 7.80 3.85 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.80 0.00 0.00 51 L 7.56 3.97 0.00 1.95 1.63 0.84 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.60 3.95 0.00 2.17 1.91 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.67 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.46 1.57 7.81 53 A 7.86 4.27 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 54 R 7.87 3.77 0.00 2.02 1.92 0.00 2.95 0.00 0.00 2.99 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 55 S 7.95 4.45 0.00 4.14 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 56 T 7.97 3.80 4.40 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 1.21 0.00 0.00 57 V 7.87 3.56 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 0.93 0.00 0.00 0.98 0.00 0.00 58 R 7.21 3.88 0.00 1.95 2.20 0.00 3.32 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 59 D 7.68 4.42 0.00 2.70 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 60 I 7.72 4.02 1.87 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 1.41 0.65 0.91 0.00 0.00 61 D 7.60 4.29 0.00 2.70 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 62 P 0.00 4.44 0.00 2.21 2.15 0.00 3.80 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 1.98 1.98 0.00 63 Q 7.95 4.14 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.43 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 64 N 7.41 4.79 0.00 2.68 2.72 0.00 0.00 7.17 8.47 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 65 D 7.59 4.47 0.00 2.65 2.56 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 0.00 0.00 0.00 0.00 66 L 7.93 4.31 0.00 1.51 1.49 0.89 0.86 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 67 T 7.96 4.07 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 1.02 0.00 0.00 68 F 7.41 5.04 0.00 2.98 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 69 L 8.44 4.92 0.00 1.52 1.49 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.63 4.76 0.00 1.77 1.76 0.00 3.15 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.44 0.00 71 I 8.03 4.66 1.69 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.54 0.76 0.00 0.00 72 R 8.42 4.55 0.00 1.67 1.77 0.00 3.50 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 73 S 8.42 4.76 0.00 3.90 3.61 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 74 K 8.68 4.28 0.00 1.80 1.85 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.46 7.81 75 K 7.88 4.22 0.00 1.78 1.86 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 76 N 7.55 4.78 0.00 2.98 3.01 0.00 0.00 5.58 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 77 E 8.74 5.01 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.36 0.00 78 I 8.21 5.12 1.77 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 0.88 0.89 0.71 0.00 0.00 79 M 8.32 4.62 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 80 V 8.16 4.93 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 0.82 0.00 0.00 1.00 0.00 0.00 81 A 8.22 4.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.96 0.00 1.83 1.44 0.00 4.00 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 83 D 9.11 4.92 0.00 3.03 2.84 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 84 K 9.10 4.14 0.00 1.93 2.06 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.54 7.81 85 D 8.16 4.80 0.00 2.15 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 0.00 0.00 0.00 86 Y 8.13 4.55 0.00 2.92 2.80 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 87 F 7.61 5.60 0.00 3.09 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 88 L 8.29 5.39 0.00 1.63 1.63 1.04 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.35 4.90 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.26 0.81 0.00 0.00 90 V 8.47 4.70 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 1.11 0.00 0.00 0.90 0.00 0.00 91 I 8.25 4.85 1.78 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.43 0.87 0.00 0.00 92 Q 8.52 5.35 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.93 0.00 0.00 0.00 0.00 0.00 2.24 2.14 0.00 93 N 8.38 4.98 0.00 2.74 2.71 0.00 0.00 6.86 8.03 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 94 P 0.00 4.64 0.00 2.17 2.08 0.00 3.91 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 95 T 8.58 3.42 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 96 E 8.23 4.10 0.00 2.06 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 2.28 2.34 0.00