NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 R 4.2809 8.2544 117.2830 55.6123 30.8452 173.9843 12 R 3.9588 8.3092 118.3959 54.9507 30.6547 173.7452 13 P 4.6355 0.0000 0.0000 62.7975 33.8982 174.3616 14 E 5.0940 9.4854 122.7353 54.6462 32.3575 174.9977 15 I 4.7904 8.7460 125.5006 59.2576 40.6613 174.0920 16 L 4.8260 8.8517 129.5874 53.3529 44.0427 174.7307 17 L 5.0209 8.5929 126.8849 52.9566 44.2546 175.5605 18 V 4.8519 8.7855 123.9311 61.3138 34.2663 173.6836 19 D 5.1294 9.0057 126.9027 53.0272 44.4676 176.4565 20 S 4.5723 8.9482 118.6349 59.7558 63.8933 174.5453 21 Q 4.5992 8.5957 121.8201 53.7481 30.6244 175.4593 22 E 3.9389 8.9528 126.0671 59.7059 29.6094 179.3353 23 V 3.6244 7.8281 118.2641 64.9891 31.2051 178.3251 24 I 3.9431 7.7287 119.8265 64.1420 37.1123 178.0570 25 L 4.1591 7.9230 119.5448 57.9327 41.4314 179.3789 26 Q 3.8939 8.3937 119.6435 59.3287 28.9858 178.6758 27 R 4.0819 8.2516 119.0834 59.2223 30.1442 179.0423 28 L 4.0573 8.5854 119.2683 57.7919 41.5368 179.1883 29 Q 4.2295 8.7018 120.0179 59.4788 28.7405 178.3532 30 Q 3.9805 8.1643 119.5323 58.9995 29.1540 177.5569 31 L 4.1677 7.9927 120.8156 57.6958 42.4101 178.1556 32 L 4.4617 8.1765 118.2038 56.0661 42.0079 178.8414 33 S 4.1412 8.2294 114.1981 61.0326 62.7932 174.0694 34 P 4.3033 0.0000 0.0000 64.1341 31.3730 176.1300 35 L 4.3105 7.4069 118.3020 52.4738 43.5832 175.2081 36 P 4.5580 0.0000 0.0000 62.3049 30.1848 175.2651 37 Y 5.1945 7.1869 115.6744 57.1700 41.9981 176.8758 38 T 4.3799 9.0016 120.6015 62.7668 69.9318 173.8125 39 L 4.9357 8.4024 126.2040 53.3234 44.1167 175.6447 40 H 4.9499 8.5617 118.6208 53.9953 33.0809 172.4390 41 F 5.4196 8.8898 119.0454 55.7414 42.3965 174.3099 42 A 4.9808 9.2334 123.8024 50.6222 22.4234 176.8438 43 R 5.0842 9.7993 118.9595 55.9104 31.2741 175.5743 44 D 4.5826 7.3861 116.9140 51.4678 43.0311 175.8272 45 A 4.0248 8.4047 120.5551 55.4757 18.3106 179.7026 46 T 3.8214 7.9457 113.8223 67.0597 68.6131 176.6540 47 Q 4.0122 9.0680 119.9557 58.7546 28.6227 178.6013 48 A 3.9764 8.0675 121.8247 55.3148 18.5947 179.7833 49 L 3.9498 8.2731 117.7428 57.6773 41.3874 179.5594 50 Q 3.9660 7.9683 119.0205 59.2036 29.3359 178.0001 51 L 4.0659 7.9475 119.9744 57.8040 41.4226 179.5381 52 L 3.6579 7.9691 117.9911 57.0822 41.5133 178.5224 53 A 4.5326 7.6420 118.1078 52.5612 18.9569 177.5670 54 S 4.6546 7.8471 109.5367 57.3950 64.4110 174.0599 55 R 4.6291 7.3970 118.1968 54.5967 33.9174 174.3745 56 E 4.1187 8.5482 120.4238 56.1718 30.1467 176.7690 57 V 4.3310 8.0084 122.2206 61.3167 34.6275 174.2326 58 D 4.6816 9.0767 127.0267 55.5773 42.7483 176.5548 59 L 5.1936 7.6272 117.1887 52.6731 45.6110 175.7423 60 V 4.7540 8.7375 123.0241 61.0787 34.4936 174.0178 61 I 4.9173 8.7785 128.8667 59.5896 39.7966 174.5686 62 S 5.1959 9.0081 121.1209 56.0368 66.1154 173.2928 63 A 5.3385 9.2929 128.0036 51.9024 19.4402 178.2160 64 A 4.0743 8.7444 120.1823 54.5178 20.1666 177.6208 65 H 4.9121 8.1742 112.0450 54.5728 29.7529 174.5867 66 L 4.9665 8.0881 122.9412 51.9748 45.7204 175.6764 67 P 4.5044 0.0000 0.0000 65.1599 33.0466 177.1968 68 Q 4.4152 7.4945 109.5819 55.5108 28.6473 178.2640 69 M 3.8799 9.4501 124.0759 57.0477 32.6801 175.3794 70 D 4.8401 8.5618 126.2215 52.2007 42.4835 177.5140 71 G 4.0231 8.7383 107.2936 47.3010 0.0000 174.2543 72 P 4.3339 0.0000 0.0000 65.2163 31.2432 178.9763 73 T 3.8667 8.4009 114.8313 66.4307 68.2918 176.4628 74 L 3.9576 8.2544 122.6493 58.3148 42.0377 179.1266 75 L 4.0157 8.4546 119.0714 57.4785 41.4769 179.3978 76 A 4.3498 8.1912 122.3746 54.7096 18.3041 179.5509 77 R 3.8668 8.2807 117.5195 59.7588 30.1194 178.8397 78 I 3.9197 8.2365 119.9641 64.5782 36.8764 177.7247 79 H 4.2512 8.6023 119.4593 59.5147 29.3961 177.3884 80 Q 3.9061 7.9461 118.8309 58.6279 28.6911 177.5934 81 Q 4.0613 8.0734 118.8852 56.6960 31.0503 175.2829 82 Y 4.7522 8.0683 116.9235 55.5481 38.1160 174.4925 83 P 4.5570 0.0000 0.0000 64.9212 32.0686 178.6064 84 S 4.3061 8.0009 113.6040 60.0578 63.1014 174.2366 85 T 4.4003 7.6747 111.0153 61.8878 69.7062 173.9341 86 T 4.7196 8.6062 118.6550 61.8579 71.7449 173.6775 87 R 5.1566 8.5372 122.9995 54.4898 34.3401 174.3066 88 I 5.0094 8.8202 123.4321 59.4295 41.1392 174.0665 89 L 4.8287 8.7553 128.9815 53.8853 43.8109 174.8726 90 L 5.2021 9.2746 129.0172 53.6939 44.2569 174.6812 91 T 5.0699 9.0388 120.5200 60.4270 71.1110 174.4315 92 G 3.8598 9.0465 114.4491 45.4474 0.0000 173.0235 93 D 4.7317 8.1152 120.6851 52.0065 41.5130 175.0844 94 P 4.5658 0.0000 0.0000 61.4098 30.2846 175.2506 95 D 4.6984 7.5799 120.6708 53.2115 42.9415 175.0763 96 L 3.8907 8.5448 129.5076 58.4319 42.0953 178.9406 97 K 3.9761 8.3300 118.2139 59.3717 31.9113 179.3839 98 L 3.9589 7.7385 118.7380 57.8060 41.6324 179.4189 99 I 3.4530 7.7120 119.5201 64.1965 36.9004 178.3582 100 A 3.9287 8.3246 122.0760 55.0334 18.1065 179.6505 101 K 3.8727 7.9730 117.4979 59.4989 32.2898 178.9541 102 A 3.9655 8.1270 121.2824 55.0017 18.1869 179.7496 103 I 3.6232 7.8919 118.4807 64.8165 37.1476 178.3936 104 N 4.4844 8.4056 116.1743 55.1411 38.6124 175.9447 105 E 4.5247 8.6129 119.4887 57.0754 31.6814 178.0860 106 G 3.6504 8.1233 105.6537 45.7409 0.0000 173.0138 107 E 3.8537 7.9130 119.2879 56.8803 27.6343 175.3736 108 I 4.0091 7.4187 110.4794 61.4634 38.5681 175.6342 109 Y 4.4430 9.1493 124.4550 60.1210 39.4694 175.7233 110 R 4.7299 7.9127 115.7405 54.5280 35.2288 173.5461 111 Y 5.4108 8.5574 121.9372 55.9945 41.3401 174.5436 112 L 4.5527 8.9281 126.0566 52.8218 45.4547 176.2301 113 S 5.0180 8.2794 117.9147 58.2698 64.3208 173.0698 114 K 4.9795 8.5801 122.5683 54.0824 34.1059 174.6373 115 P 4.1501 0.0000 0.0000 62.1598 32.0225 176.2056 116 W 4.7160 7.6011 117.4308 55.0889 29.6933 175.3770 117 D 4.7756 8.5174 118.0448 53.0341 41.8785 176.2230 118 D 4.6657 9.0080 127.3984 58.0609 40.9876 179.0119 119 Q 4.0416 8.1819 117.7220 59.0317 28.7373 178.5398 120 E 4.0277 8.4275 119.2341 59.1137 29.6108 178.9458 121 L 3.8910 8.3480 120.8485 58.1359 42.1294 179.0394 122 L 4.0356 8.2830 119.3558 57.5542 41.5117 179.1528 123 L 3.9394 8.0852 120.1161 58.2361 41.9559 178.8695 124 A 4.1026 8.1913 120.6736 55.2298 18.1635 179.6842 125 L 3.8925 8.0123 117.4610 57.9410 41.7004 179.8607 126 R 3.9704 8.2266 118.1121 59.4497 29.9276 179.2077 127 Q 4.0759 8.7128 118.0570 58.8402 28.6326 178.5962 128 A 3.5751 8.4469 122.1523 55.0899 18.4458 179.7385 129 L 3.7009 8.1767 117.8258 57.8042 41.7580 179.3675 130 E 3.9621 8.2443 119.4534 59.3654 29.6653 178.4338 131 H 4.1844 8.4644 118.7216 59.1899 29.6937 177.0367 132 Q 3.8214 8.3719 121.0587 59.1552 28.8733 177.3621 133 H 4.2505 8.0169 118.7538 59.3388 30.0399 176.9308 134 S 4.2839 7.3451 112.9821 60.2762 63.3786 173.8418 135 E 4.0475 7.7451 125.6666 56.4911 29.1536 176.4235 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 11 R 8.25 4.28 0.00 1.94 2.06 0.00 3.00 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 12 R 8.31 3.96 0.00 1.90 1.89 0.00 3.26 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.99 0.00 13 P 0.00 4.64 0.00 1.92 1.79 0.00 3.99 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 2.24 2.13 0.00 14 E 9.49 5.09 0.00 1.83 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 2.23 0.00 15 I 8.75 4.79 1.68 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.55 0.72 0.00 0.00 16 L 8.85 4.83 0.00 1.61 1.41 0.90 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.59 5.02 0.00 1.46 1.54 0.68 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.79 4.85 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 1.05 0.00 0.00 0.91 0.00 0.00 19 D 9.01 5.13 0.00 2.82 2.52 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 20 S 8.95 4.57 0.00 4.05 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 21 Q 8.60 4.60 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 22 E 8.95 3.94 0.00 2.07 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 2.37 2.45 0.00 23 V 7.83 3.62 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 0.83 0.00 0.00 0.93 0.00 0.00 24 I 7.73 3.94 2.26 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.07 1.30 0.00 0.00 25 L 7.92 4.16 0.00 1.85 1.74 1.08 0.85 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 26 Q 8.39 3.89 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 27 R 8.25 4.08 0.00 2.38 2.28 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 28 L 8.59 4.06 0.00 1.99 1.75 0.90 0.16 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 29 Q 8.70 4.23 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 30 Q 8.16 3.98 0.00 2.20 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 31 L 7.99 4.17 0.00 1.94 1.93 1.03 1.09 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 32 L 8.18 4.46 0.00 1.88 1.83 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.23 4.14 0.00 4.03 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 34 P 0.00 4.30 0.00 2.02 2.13 0.00 3.77 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 2.03 2.10 0.00 35 L 7.41 4.31 0.00 1.15 0.39 0.83 1.03 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 36 P 0.00 4.56 0.00 2.15 2.02 0.00 3.13 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 37 Y 7.19 5.19 0.00 2.77 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 38 T 9.00 4.38 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 1.21 0.00 0.00 39 L 8.40 4.94 0.00 1.44 0.96 1.10 1.05 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 40 H 8.56 4.95 0.00 2.87 3.05 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.89 5.42 0.00 2.89 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 42 A 9.23 4.98 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 43 R 9.80 5.08 0.00 1.93 1.99 0.00 3.57 0.00 0.00 3.35 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 44 D 7.39 4.58 0.00 2.91 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 45 A 8.40 4.02 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 46 T 7.95 3.82 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 1.22 0.00 0.00 47 Q 9.07 4.01 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 48 A 8.07 3.98 1.36 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 0.00 0.00 0.00 49 L 8.27 3.95 0.00 1.83 1.78 0.96 0.96 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 50 Q 7.97 3.97 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 51 L 7.95 4.07 0.00 1.80 1.57 0.96 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.97 3.66 0.00 1.44 0.56 0.82 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.64 4.53 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 54 S 7.85 4.65 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 55 R 7.40 4.63 0.00 1.59 1.58 0.00 3.32 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.27 0.00 56 E 8.55 4.12 0.00 2.11 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 2.30 2.28 0.00 57 V 8.01 4.33 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 0.74 0.00 0.00 0.74 0.00 0.00 58 D 9.08 4.68 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 5.19 0.00 1.39 1.39 0.70 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.74 4.75 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 1.03 0.00 0.00 0.85 0.00 0.00 61 I 8.78 4.92 1.78 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 0.58 0.83 0.00 0.00 62 S 9.01 5.20 0.00 3.85 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 63 A 9.29 5.34 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 64 A 8.74 4.07 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 65 H 8.17 4.91 0.00 3.18 3.28 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.09 4.97 0.00 1.84 1.51 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.50 0.00 2.19 2.20 0.00 3.73 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 2.01 2.01 0.00 68 Q 7.49 4.42 0.00 2.09 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 69 M 9.45 3.88 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 70 D 8.56 4.84 0.00 3.16 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 71 G 8.74 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 72 P 0.00 4.33 0.00 2.15 2.16 0.00 3.77 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 2.07 2.14 0.00 73 T 8.40 3.87 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 1.22 0.00 0.00 74 L 8.25 3.96 0.00 1.80 1.89 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.45 4.02 0.00 1.83 1.72 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.19 4.35 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 77 R 8.28 3.87 0.00 1.94 2.18 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 78 I 8.24 3.92 2.05 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 1.50 0.60 1.00 0.00 0.00 79 H 8.60 4.25 0.00 3.24 3.53 0.00 5.78 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 80 Q 7.95 3.91 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.64 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 81 Q 8.07 4.06 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.27 0.00 0.00 0.00 0.00 0.00 1.22 2.02 0.00 82 Y 8.07 4.75 0.00 3.07 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 83 P 0.00 4.56 0.00 2.16 2.23 0.00 3.31 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 84 S 8.00 4.31 0.00 3.90 3.94 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 85 T 7.67 4.40 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 1.31 0.00 0.00 86 T 8.61 4.72 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 0.93 0.00 0.00 87 R 8.54 5.16 0.00 1.75 1.79 0.00 3.20 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 88 I 8.82 5.01 1.87 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 1.21 0.78 0.98 0.00 0.00 89 L 8.76 4.83 0.00 1.83 1.67 0.99 0.06 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 90 L 9.27 5.20 0.00 1.74 1.55 1.11 0.13 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 91 T 9.04 5.07 4.42 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 1.46 0.00 0.00 92 G 9.05 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 93 D 8.12 4.73 0.00 2.73 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 94 P 0.00 4.57 0.00 2.28 2.18 0.00 3.84 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 2.01 1.99 0.00 95 D 7.58 4.70 0.00 2.92 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 96 L 8.54 3.89 0.00 1.77 1.65 0.89 0.66 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 97 K 8.33 3.98 0.00 1.93 1.82 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 98 L 7.74 3.96 0.00 1.76 1.64 0.85 0.80 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 99 I 7.71 3.45 1.67 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.36 0.49 0.00 0.00 100 A 8.32 3.93 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 0.00 101 K 7.97 3.87 0.00 1.84 1.92 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.42 1.59 7.81 102 A 8.13 3.97 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 0.00 103 I 7.89 3.62 1.98 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 1.50 0.62 0.90 0.00 0.00 104 N 8.41 4.48 0.00 2.72 2.86 0.00 0.00 7.00 7.30 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 0.00 105 E 8.61 4.52 0.00 2.12 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 2.22 2.21 0.00 106 G 8.12 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 0.00 107 E 7.91 3.85 0.00 1.85 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 0.00 2.31 2.06 0.00 108 I 7.42 4.01 2.07 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 1.28 0.55 0.99 0.00 0.00 109 Y 9.15 4.44 0.00 2.84 3.11 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 0.00 110 R 7.91 4.73 0.00 1.73 1.70 0.00 3.15 0.00 0.00 2.97 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 111 Y 8.56 5.41 0.00 2.80 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 0.00 112 L 8.93 4.55 0.00 1.55 1.46 0.89 0.98 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 0.00 113 S 8.28 5.02 0.00 3.73 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 0.00 114 K 8.58 4.98 0.00 1.90 1.77 0.00 1.90 0.00 0.00 2.04 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.85 1.59 7.81 115 P 0.00 4.15 0.00 1.91 1.81 0.00 3.72 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 1.89 1.85 0.00 116 W 7.60 4.72 0.00 3.39 3.31 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 0.00 117 D 8.52 4.78 0.00 2.85 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 0.00 118 D 9.01 4.67 0.00 2.83 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 0.00 119 Q 8.18 4.04 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 120 E 8.43 4.03 0.00 2.14 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 2.64 2.32 0.00 121 L 8.35 3.89 0.00 1.62 1.56 0.71 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.28 4.04 0.00 1.74 1.74 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.09 3.94 0.00 1.85 1.86 0.94 0.93 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 0.00 124 A 8.19 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 0.00 125 L 8.01 3.89 0.00 1.95 1.64 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.23 3.97 0.00 2.03 2.02 0.00 3.16 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.96 0.00 127 Q 8.71 4.08 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 128 A 8.45 3.58 1.36 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 0.00 0.00 0.00 129 L 8.18 3.70 0.00 1.71 1.68 0.57 0.90 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 0.00 130 E 8.24 3.96 0.00 2.11 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 0.00 2.33 2.39 0.00 131 H 8.46 4.18 0.00 3.19 3.01 0.00 5.84 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.37 3.82 0.00 1.95 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 133 H 8.02 4.25 0.00 3.25 3.55 0.00 5.99 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 7.35 4.28 0.00 4.14 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 0.00 135 E 7.75 4.05 0.00 1.91 1.81 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 2.14 1.98 0.00