NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.6232 8.3649 120.3117 53.1847 41.3956 176.5036 3 K 3.9513 7.9381 117.4507 57.3099 32.5448 175.1787 4 I 4.3699 8.3471 121.4470 60.2505 38.9555 175.5856 5 I 3.7568 8.3546 129.0336 61.7048 38.0941 175.0669 6 H 4.7958 8.8687 127.8595 55.2150 29.1414 174.6062 7 L 4.5727 8.5384 125.5588 54.4530 42.4588 176.1644 8 T 4.9290 8.5183 110.2010 59.0806 72.0889 174.7177 9 D 4.4128 9.3291 122.2456 57.8503 40.7705 178.6718 10 D 4.5207 8.1493 116.8919 56.3398 41.6174 177.1767 11 S 4.5899 7.8305 113.3213 58.3443 63.5602 175.6399 12 F 3.9102 7.9334 125.1960 61.8208 39.0500 176.0765 13 D 4.4730 8.4435 117.6758 58.1450 40.4133 179.3248 14 T 3.8097 7.6920 113.7747 66.9772 68.7460 176.3260 15 D 4.3984 8.0566 119.2167 56.1172 40.6811 176.4962 16 V 3.7956 7.4568 116.3499 64.1473 33.6841 177.6142 17 L 4.0411 7.4332 118.9460 57.0647 41.6565 178.7640 18 K 4.4102 7.9923 115.2746 56.0999 32.8828 176.3620 19 A 4.3352 7.2022 121.2748 51.3347 19.4852 176.9527 20 D 4.6158 8.4132 121.1525 53.9112 41.9760 177.2338 21 G 3.9556 8.6105 105.3679 45.1444 0.0000 172.1243 22 A 4.8991 8.1152 119.9252 51.3197 20.4858 176.6609 23 I 4.9255 8.6541 121.5300 59.4774 41.3809 174.2302 24 L 4.8038 9.0413 130.5534 54.1212 43.4775 175.2416 25 V 4.6671 9.1101 127.8093 61.3726 33.6437 173.9277 26 D 5.0296 9.2468 129.2666 53.0975 42.4742 175.1114 27 F 5.2002 9.1848 126.8447 56.4078 40.4476 175.3348 28 W 5.5956 9.0182 120.0964 55.5246 32.3698 173.2798 29 A 3.7368 7.9235 119.3220 50.0937 21.3153 176.9502 30 E 3.9570 8.2902 121.0029 59.0331 29.7111 178.4479 31 W 4.3667 7.4387 113.4715 57.8841 28.8611 176.8837 32 C 4.6048 7.5190 121.0747 55.7969 38.7130 173.3195 33 G 3.6362 8.8612 115.8852 47.5005 0.0000 172.8491 34 P 4.2806 0.0000 0.0000 65.1525 30.9366 179.2941 35 C 4.2205 8.1974 114.6536 60.2428 39.9554 176.2675 36 K 3.8829 7.7034 118.3706 59.4151 31.7027 179.0923 37 M 4.1916 7.8643 118.6255 57.7529 32.1652 177.8994 38 I 4.0536 7.7594 111.4445 61.3364 38.3931 177.3673 39 A 3.7219 7.3425 122.7508 55.3441 18.2906 177.9931 40 P 4.3889 0.0000 0.0000 65.3220 31.3971 179.0321 41 I 3.7690 7.5979 118.7700 64.2255 37.0402 178.1666 42 L 3.9861 7.8072 119.9712 57.6025 41.5260 179.1697 43 D 4.3329 7.9125 118.5806 57.3736 40.6623 178.7009 44 E 3.9896 8.0413 118.5830 59.5635 29.4743 179.5526 45 I 3.8793 8.0046 119.6801 64.3105 36.9136 178.3811 46 A 4.0297 8.2539 121.3302 54.9430 18.5552 179.0810 47 D 4.3824 8.0456 116.2390 57.7553 41.2435 178.3844 48 E 4.0314 8.4286 118.0978 58.9692 29.5949 177.9783 49 Y 4.4743 8.1450 115.2841 56.6198 38.4008 174.9964 50 Q 4.0827 7.3088 121.3251 58.0583 29.5763 175.2418 51 G 4.3026 9.1454 113.7804 45.5317 0.0000 174.3168 52 K 4.2211 7.7651 118.8072 57.9470 32.8141 176.2693 53 L 4.8149 8.1419 119.2359 53.9821 45.5270 174.9971 54 T 4.5427 8.6493 122.6775 62.1857 70.6909 173.7305 55 V 4.6752 8.3043 125.7229 61.5980 33.6421 174.3340 56 A 5.1250 9.3146 128.4400 50.1736 23.0917 174.6943 57 K 4.9376 8.9527 119.6239 54.3955 35.7158 175.1218 58 L 4.8015 9.0653 126.1920 53.1049 44.8325 174.8110 59 N 4.2722 8.6953 126.4440 52.8061 39.2447 175.5057 60 I 4.0419 8.2775 121.1625 63.3546 38.4699 178.5811 61 D 4.3769 8.2530 122.3159 57.5620 40.9326 177.7644 62 Q 4.1577 8.2546 116.6136 58.4347 28.9038 176.7393 63 N 4.9841 8.2459 115.2806 50.9293 38.9344 172.8181 64 P 4.8846 0.0000 0.0000 62.6677 32.3431 178.3234 65 G 3.8296 8.6424 109.0772 48.1694 0.0000 175.9037 66 T 3.9202 8.3277 116.8168 66.4532 68.9671 176.5896 67 A 3.7733 8.3049 122.7833 54.8888 18.4308 177.8419 68 P 4.2271 0.0000 0.0000 65.1359 31.1880 178.6362 69 K 4.0225 7.7733 116.1639 58.2356 30.5616 177.0285 70 Y 4.5422 7.6225 115.9497 56.8327 38.8516 176.0901 71 G 4.0899 7.9696 106.6260 46.3181 0.0000 174.3455 72 I 3.6752 7.0442 120.6176 61.3988 37.0504 176.4428 73 R 4.2994 8.5523 125.0969 57.6075 30.8214 176.5138 74 S 4.7907 7.6257 109.7761 56.7273 66.0335 172.8534 75 I 4.7728 8.0016 113.6670 58.0757 40.2730 173.4032 76 P 5.0955 0.0000 0.0000 62.7638 33.0059 175.0271 77 T 5.0305 8.5511 117.5401 61.8945 72.6049 172.4452 78 L 5.3017 9.0277 126.4284 53.1302 44.1959 175.2762 79 L 5.0438 8.9994 124.1393 52.8787 44.3973 175.0962 80 L 5.0935 8.6664 126.7150 53.8400 43.9100 174.9832 81 F 5.2561 9.4097 125.3426 55.7247 41.8671 174.7807 82 K 4.7698 9.0359 121.9179 55.4052 35.6005 176.3487 83 N 4.0216 9.1303 124.1096 54.7226 37.7439 174.9587 84 G 4.1436 8.3503 104.3960 46.3650 0.0000 173.1109 85 E 4.8735 8.1574 119.5354 53.8617 32.2265 175.6908 86 V 3.3621 8.3532 122.0552 63.0833 31.9795 175.2556 87 A 4.6331 8.4121 128.6342 53.1104 20.9989 176.1369 88 A 4.7014 7.4475 114.6011 51.5386 22.6671 175.3996 89 T 5.3053 8.4683 108.1641 60.1870 72.4335 173.1855 90 K 4.4708 9.0224 123.6410 54.6971 35.6756 174.7797 91 V 4.4175 8.6874 127.1065 62.4256 33.0593 175.9523 92 G 3.9067 8.9927 113.5392 44.5970 0.0000 172.6435 93 A 4.1727 7.9572 121.5117 52.2580 18.9043 176.5620 94 L 4.4347 7.6939 118.4862 53.5286 43.2054 175.6002 95 S 4.4771 9.3262 115.7150 57.2487 65.2526 175.2881 96 K 3.9780 8.5162 122.5251 59.6573 32.0784 178.6080 97 G 3.7848 8.1752 105.4195 48.2463 0.0000 175.3033 98 Q 4.2320 7.8532 120.7586 58.6174 28.6713 178.7967 99 L 4.0401 8.0788 121.3513 57.8199 42.0251 179.0917 100 K 4.0763 8.4349 118.9563 59.5760 32.0459 179.0913 101 E 3.9996 8.1844 118.4214 59.2228 28.5840 179.0108 102 F 4.1106 8.4067 120.6696 61.4850 39.4350 177.1657 103 L 4.0084 8.2012 118.4546 57.9627 41.4913 179.3617 104 D 4.3943 8.4443 118.4447 57.1127 40.4479 178.6645 105 A 4.0450 7.5678 120.1596 54.0626 18.3962 178.2417 106 N 4.7336 7.2426 112.8790 52.9498 40.3668 175.9265 107 L 4.2222 7.9953 118.7017 57.3554 43.1602 176.1808 108 A 4.1971 7.3073 123.7558 51.8724 18.6375 176.2086 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 D 8.36 4.62 0.00 2.79 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 3 K 7.94 3.95 0.00 1.84 1.90 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.51 7.81 4 I 8.35 4.37 1.81 0.00 0.00 0.75 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 0.43 0.86 0.00 0.00 5 I 8.35 3.76 1.82 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 1.07 0.88 0.89 0.00 0.00 6 H 8.87 4.80 0.00 3.20 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.54 4.57 0.00 1.76 1.71 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.52 4.93 4.38 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 1.29 0.00 0.00 9 D 9.33 4.41 0.00 2.67 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 10 D 8.15 4.52 0.00 2.68 2.72 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 11 S 7.83 4.59 0.00 4.04 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 12 F 7.93 3.91 0.00 3.33 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 13 D 8.44 4.47 0.00 2.77 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 14 T 7.69 3.81 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 1.19 0.00 0.00 15 D 8.06 4.40 0.00 2.51 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 16 V 7.46 3.80 0.67 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 -0.56 0.00 0.00 0.09 0.00 0.00 17 L 7.43 4.04 0.00 1.95 1.74 1.18 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.99 4.41 0.00 1.85 1.82 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 19 A 7.20 4.34 1.20 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 0.00 0.00 20 D 8.41 4.62 0.00 2.67 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 21 G 8.61 3.96 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 0.00 0.00 0.00 22 A 8.12 4.90 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 23 I 8.65 4.93 1.82 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 1.04 0.79 0.84 0.00 0.00 24 L 9.04 4.80 0.00 1.75 1.53 1.02 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.11 4.67 2.45 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 0.55 0.00 0.00 0.90 0.00 0.00 26 D 9.25 5.03 0.00 2.68 2.45 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 27 F 9.18 5.20 0.00 3.18 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 28 W 9.02 5.60 0.00 3.37 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 29 A 7.92 3.74 0.35 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 30 E 8.29 3.96 0.00 1.80 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 2.35 2.45 0.00 31 W 7.44 4.37 0.00 3.56 3.22 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 32 C 7.52 4.60 0.00 1.72 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 33 G 8.86 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 34 P 0.00 4.28 0.00 2.17 2.13 0.00 3.65 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 2.15 2.22 0.00 35 C 8.20 4.22 0.00 3.19 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 36 K 7.70 3.88 0.00 1.81 1.87 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.29 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.70 7.81 37 M 7.86 4.19 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.82 0.00 38 I 7.76 4.05 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.59 0.92 0.00 0.00 39 A 7.34 3.72 1.16 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 40 P 0.00 4.39 0.00 2.13 2.07 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 41 I 7.60 3.77 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.62 0.88 0.00 0.00 42 L 7.81 3.99 0.00 1.74 1.62 0.78 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.91 4.33 0.00 2.88 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 44 E 8.04 3.99 0.00 2.22 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 2.33 2.40 0.00 45 I 8.00 3.88 1.85 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.87 0.76 0.00 0.00 46 A 8.25 4.03 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 47 D 8.05 4.38 0.00 2.93 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 48 E 8.43 4.03 0.00 2.08 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 2.33 2.47 0.00 49 Y 8.15 4.47 0.00 3.10 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 50 Q 7.31 4.08 0.00 2.46 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.38 2.20 0.00 51 G 9.15 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 0.00 0.00 0.00 52 K 7.77 4.22 0.00 1.76 2.09 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.47 7.81 53 L 8.14 4.81 0.00 1.67 1.57 0.95 0.83 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 54 T 8.65 4.54 4.21 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 1.18 0.00 0.00 55 V 8.30 4.68 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 0.91 0.00 0.00 0.92 0.00 0.00 56 A 9.31 5.13 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 57 K 8.95 4.94 0.00 1.67 1.78 0.00 1.36 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.18 1.17 7.81 58 L 9.07 4.80 0.00 1.41 0.89 0.88 0.60 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 59 N 8.70 4.27 0.00 2.42 2.47 0.00 0.00 6.92 7.78 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 60 I 8.28 4.04 1.94 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 1.35 1.38 1.11 0.00 0.00 61 D 8.25 4.38 0.00 2.76 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 62 Q 8.25 4.16 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.17 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 63 N 8.25 4.98 0.00 2.81 2.89 0.00 0.00 6.66 8.23 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 64 P 0.00 4.88 0.00 2.19 2.17 0.00 3.47 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 65 G 8.64 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 0.00 0.00 0.00 66 T 8.33 3.92 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 0.52 0.00 0.00 67 A 8.30 3.77 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 68 P 0.00 4.23 0.00 2.13 2.09 0.00 3.81 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 2.10 2.16 0.00 69 K 7.77 4.02 0.00 1.63 1.41 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.57 7.81 70 Y 7.62 4.54 0.00 2.95 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 71 G 7.97 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 0.00 0.00 0.00 72 I 7.04 3.68 1.62 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.38 0.78 0.00 0.00 73 R 8.55 4.30 0.00 1.79 1.98 0.00 3.19 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 74 S 7.63 4.79 0.00 3.97 3.82 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 75 I 8.00 4.77 1.98 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.67 1.04 0.00 0.00 76 P 0.00 5.10 0.00 2.14 2.23 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.82 0.00 77 T 8.55 5.03 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 1.26 0.00 0.00 78 L 9.03 5.30 0.00 1.40 1.56 0.73 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.00 5.04 0.00 1.95 1.47 0.93 0.04 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 80 L 8.67 5.09 0.00 1.93 1.55 1.00 0.70 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 81 F 9.41 5.26 0.00 2.89 2.91 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 82 K 9.04 4.77 0.00 1.65 1.67 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.33 7.81 83 N 9.13 4.02 0.00 2.95 2.90 0.00 0.00 7.31 7.86 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 84 G 8.35 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 0.00 0.00 0.00 85 E 8.16 4.87 0.00 2.04 1.88 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 2.30 2.46 0.00 86 V 8.35 3.36 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 0.61 0.00 0.00 0.58 0.00 0.00 87 A 8.41 4.63 1.18 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 0.00 0.00 88 A 7.45 4.70 1.06 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 0.00 0.00 89 T 8.47 5.31 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 1.19 0.00 0.00 90 K 9.02 4.47 0.00 0.79 1.11 0.00 1.43 0.00 0.00 1.41 0.00 0.00 2.66 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.05 0.91 7.81 91 V 8.69 4.42 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 0.84 0.00 0.00 0.92 0.00 0.00 92 G 8.99 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 93 A 7.96 4.17 1.23 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 0.00 0.00 94 L 7.69 4.43 0.00 1.83 1.54 0.74 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 95 S 9.33 4.48 0.00 4.02 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 96 K 8.52 3.98 0.00 1.85 1.86 0.00 1.93 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.55 1.54 7.81 97 G 8.18 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 Q 7.85 4.23 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 99 L 8.08 4.04 0.00 1.82 1.81 0.88 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.43 4.08 0.00 2.12 1.98 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.77 1.76 7.81 101 E 8.18 4.00 0.00 2.30 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 2.37 2.36 0.00 102 F 8.41 4.11 0.00 3.12 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 0.00 103 L 8.20 4.01 0.00 1.59 1.51 0.24 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.44 4.39 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.57 4.04 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 0.00 106 N 7.24 4.73 0.00 2.64 2.69 0.00 0.00 6.90 7.73 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 0.00 107 L 8.00 4.22 0.00 1.67 1.73 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.31 4.20 1.39 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 0.00 0.00