NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2713 8.3144 120.1356 55.6718 33.5272 175.1574 2 E 3.8084 8.6341 123.0023 54.8600 30.1539 176.0007 3 T 4.2526 8.7187 118.2786 61.1530 72.1863 175.0561 4 A 3.9940 8.5212 123.2823 55.3226 18.5190 179.9330 5 A 4.1073 8.0009 118.6189 55.3346 18.5270 179.6065 6 A 4.0365 8.1531 119.4013 55.0376 18.3756 179.7785 7 K 4.0251 8.4000 118.4923 59.5264 32.2848 178.7020 8 F 4.0632 8.4992 121.0513 61.3849 39.2662 176.9427 9 E 4.0294 8.2759 117.6032 59.5170 29.0904 179.3710 10 R 3.8924 7.8917 117.3710 59.6033 30.2249 178.2839 11 Q 3.9421 8.1725 117.2149 58.2910 29.0204 176.5186 12 H 4.5980 7.9244 114.3747 54.2835 31.9195 173.6749 13 M 4.6775 7.8879 118.1794 54.1562 33.5288 176.5789 14 D 4.7424 9.1313 122.8481 53.0628 42.1216 175.5598 15 S 4.5257 8.5843 116.4311 59.0092 63.4832 175.2223 16 S 4.4953 8.0817 114.7106 59.1619 63.4787 174.1445 17 T 4.7304 7.4121 109.8601 60.1430 71.5487 173.9027 18 S 4.3014 8.4683 117.7155 60.2210 63.5432 173.9830 19 A 3.8763 6.9695 119.5463 50.7593 21.3324 175.5241 20 A 3.3267 8.0867 123.2565 52.1844 18.7264 178.0600 21 S 4.5907 8.3250 115.6784 58.2098 64.4844 173.5945 22 S 4.6101 7.4512 114.9062 57.1811 65.2138 175.4167 23 S 4.2391 8.6429 115.3141 61.0046 62.8224 174.8452 24 N 4.6721 8.1181 117.3361 53.7593 39.0169 176.0873 25 Y 3.9786 8.1221 120.5663 61.1588 38.6943 177.5590 26 C 4.1903 8.3542 117.0794 60.0208 38.7834 175.7352 27 N 4.4208 8.2577 117.5460 56.6851 38.0866 177.3424 28 Q 3.9298 8.0601 119.1543 59.1909 28.8326 178.6486 29 M 3.7124 7.7710 119.9051 58.3354 31.8348 178.7004 30 M 4.0504 8.1413 119.2940 58.0896 32.0567 178.8312 31 K 3.9168 7.6857 119.0136 59.7833 32.2759 179.2799 32 S 4.1805 8.0244 114.1171 61.0487 62.7239 175.8555 33 R 4.3180 7.7627 118.4680 55.3434 29.9865 175.9825 34 N 4.2913 7.9054 114.8792 54.5551 36.2937 175.1747 35 L 4.3305 7.9362 118.1351 55.8253 42.1784 178.2884 36 T 5.2878 7.5678 106.9202 60.3814 69.2702 174.9914 37 K 4.1697 8.3503 124.6762 59.7587 32.3279 177.3673 38 D 4.7405 7.8690 116.0537 55.1829 42.3223 176.1727 39 R 3.9233 7.2348 112.7837 55.1664 31.5199 174.3090 40 C 4.8878 8.7426 117.1257 56.1397 40.5066 173.8862 41 K 4.2948 8.0019 128.9431 55.7034 32.5515 175.1109 42 P 4.7800 0.0000 0.0000 65.6081 32.5672 176.3390 43 V 5.1131 7.6020 110.7075 60.1739 35.8697 173.7780 44 N 4.7255 8.8287 120.1070 53.0717 42.6515 173.0862 45 T 4.8944 7.7139 117.9781 61.6157 72.4143 172.9021 46 F 4.8477 8.9713 124.4416 55.6239 42.2030 174.6375 47 V 4.5675 8.9129 122.5375 61.0590 33.5617 175.6614 48 H 5.4780 8.6371 128.4683 53.7789 26.2994 173.3642 49 E 4.8000 7.6892 117.7288 53.3044 34.5667 176.5167 50 S 4.3438 8.3946 115.1020 58.2772 64.9901 174.9684 51 L 3.9980 8.5626 124.8282 58.4773 41.8964 179.2479 52 A 4.2065 7.9983 120.1568 55.3835 18.1323 179.2120 53 D 4.3502 7.9272 116.5618 57.3428 41.1329 178.9053 54 V 3.7886 7.7648 118.4725 66.0955 31.7405 178.1108 55 Q 3.9082 8.5803 118.0287 58.8696 28.4757 178.6647 56 A 4.0598 8.0737 121.3894 54.4930 18.3031 179.6297 57 V 3.4307 7.6179 117.1315 65.9737 31.2980 176.9225 58 C 3.7462 7.7155 114.4658 57.9621 39.8978 174.1370 59 S 4.6242 7.5472 114.2892 57.9509 63.8144 174.7334 60 Q 4.2511 7.3731 121.1845 56.0699 30.6394 176.8502 61 K 4.2762 8.0839 129.8205 56.7394 33.1839 175.7723 62 N 4.4805 8.8067 127.2905 53.6275 39.2123 174.3049 63 V 4.5908 8.3940 117.9763 59.2211 36.8517 174.6583 64 A 4.2945 8.4002 125.2918 52.2094 18.9670 178.6444 65 C 4.6838 9.0019 120.2253 56.2439 41.0723 175.1305 66 K 3.7188 9.1972 121.7130 59.5664 31.5969 178.0506 67 N 4.6048 8.0962 113.1904 52.6853 37.5239 175.8101 68 G 3.9504 8.1742 108.6018 45.4829 0.0000 174.3893 69 Q 4.1785 8.3411 119.1462 56.4586 29.1951 176.6344 70 T 4.5547 8.3248 108.6317 61.6178 69.2602 173.7406 71 N 4.9845 7.9938 118.1725 53.7518 38.6203 174.9097 72 C 5.3521 7.4262 116.0983 56.9203 44.3661 172.5498 73 Y 5.0434 8.7129 117.9948 56.5498 42.3016 173.8112 74 Q 5.1454 9.0905 125.5670 54.0567 31.4064 174.9678 75 S 4.4930 8.7094 121.5657 58.5959 63.2682 174.3160 76 Y 4.5085 9.0815 120.7466 60.4302 37.9267 176.1095 77 S 5.0629 7.8259 112.5630 56.2351 65.2007 173.9851 78 T 4.2358 8.2820 113.6170 61.9178 69.8169 173.4825 79 M 5.0636 8.8926 121.7258 53.4108 36.8592 174.6757 80 S 4.8637 9.3446 117.4502 58.2686 63.6065 173.0999 81 I 5.2210 8.9081 120.0537 59.4737 41.6444 174.1707 82 T 5.0633 8.9050 119.5708 61.9052 71.6896 172.6029 83 D 5.1012 9.0979 126.7721 53.3254 43.3621 174.2618 84 C 5.6451 9.2923 123.0635 55.2259 41.3151 172.9685 85 R 5.3034 8.8935 123.4435 54.1342 33.2872 173.9556 86 E 4.1916 9.1131 127.8242 56.6638 30.4855 176.4960 87 T 4.4070 8.4465 117.1363 60.1432 70.9958 176.0000 88 G 3.6490 8.6774 110.0793 48.0880 0.0000 174.6265 89 S 4.4446 7.3900 112.8731 58.5238 63.3253 174.4564 90 S 4.1915 7.5710 116.7919 58.0206 62.6706 173.6188 91 K 4.3302 8.7154 128.6663 55.1499 34.3178 174.3670 92 Y 4.2416 8.7881 127.9510 57.8917 38.9268 174.1622 93 P 3.3317 0.0000 0.0000 62.8047 32.5137 176.5730 94 N 4.6257 7.8492 120.0642 52.1091 36.9720 173.5140 95 C 4.5719 7.8286 116.4110 56.8292 42.8162 173.4808 96 A 5.0752 8.1783 124.8998 50.4502 22.1675 174.4834 97 Y 5.0723 9.1773 118.2556 56.0583 42.5309 174.8092 98 K 4.4483 9.2659 124.4314 55.9648 33.9478 175.3332 99 T 5.0871 8.5645 123.9584 62.5791 70.1200 174.1963 100 T 4.6932 8.8338 122.5796 61.8568 72.2627 173.3453 101 Q 4.8095 8.7985 124.6681 55.5582 30.3326 174.7168 102 A 4.6627 8.7232 122.6337 51.1612 23.6692 175.1932 103 N 5.3791 8.6250 115.3691 51.8302 41.4408 174.2156 104 K 4.7675 8.8568 122.4167 54.7053 37.5213 175.8414 105 H 4.8097 8.8659 118.8435 55.9650 30.0581 174.6118 106 I 4.8092 8.3635 114.8740 59.3560 40.6702 174.4166 107 I 4.8928 8.0690 124.1320 59.7245 40.1940 175.0466 108 V 4.7984 8.6301 119.2943 59.3677 35.9978 174.4015 109 A 5.0593 8.7580 124.7981 50.9900 20.8180 175.6540 110 C 5.2093 8.6645 118.4998 55.3167 40.8452 173.3385 111 E 4.7584 8.6406 119.9287 55.9408 34.4719 175.2914 112 G 4.0108 9.7853 107.2864 44.9197 0.0000 171.9055 113 N 5.0738 8.1337 115.8865 50.6599 40.4588 172.0939 114 P 4.3196 0.0000 0.0000 62.8291 31.9917 175.5535 115 Y 4.9369 8.3131 121.9194 56.7699 39.0374 174.6264 116 V 4.4473 8.1728 119.4918 58.4917 36.6523 173.4671 117 P 4.5201 0.0000 0.0000 62.8857 31.1326 176.8881 118 V 4.4658 8.5483 115.5696 61.2292 33.9867 175.2895 119 H 5.0284 7.9163 119.7409 54.8290 33.5030 171.7172 120 F 4.5877 8.7982 127.9812 57.3429 39.4058 174.4357 121 D 4.5842 8.5123 127.1110 56.2505 41.8255 175.9609 122 A 4.6514 6.6986 116.9958 51.2752 22.4710 174.8200 123 S 5.1932 8.8291 113.4397 56.7103 65.9110 174.6187 124 V 4.1512 8.5645 114.6484 61.7656 32.1347 175.2502 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 K 8.31 4.27 0.00 1.77 1.82 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 E 8.63 3.81 0.00 2.02 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 2.32 2.38 0.00 3 T 8.72 4.25 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 1.22 0.00 0.00 4 A 8.52 3.99 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 5 A 8.00 4.11 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 6 A 8.15 4.04 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 7 K 8.40 4.03 0.00 1.99 2.08 0.00 1.52 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.53 7.81 8 F 8.50 4.06 0.00 3.16 3.25 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 9 E 8.28 4.03 0.00 2.29 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 0.00 2.51 2.70 0.00 10 R 7.89 3.89 0.00 1.81 2.08 0.00 3.37 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.17 3.94 0.00 1.64 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.53 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 12 H 7.92 4.60 0.00 2.14 2.69 0.00 5.61 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 13 M 7.89 4.68 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.67 0.00 14 D 9.13 4.74 0.00 2.73 2.54 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 15 S 8.58 4.53 0.00 3.93 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 16 S 8.08 4.50 0.00 4.02 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 17 T 7.41 4.73 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 1.26 0.00 0.00 18 S 8.47 4.30 0.00 3.83 3.93 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 19 A 6.97 3.88 1.05 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 0.00 0.00 20 A 8.09 3.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.33 4.59 0.00 3.96 3.93 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 22 S 7.45 4.61 0.00 4.00 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 23 S 8.64 4.24 0.00 4.03 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 24 N 8.12 4.67 0.00 2.87 2.88 0.00 0.00 6.43 7.04 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 25 Y 8.12 3.98 0.00 3.13 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 26 C 8.35 4.19 0.00 3.17 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 27 N 8.26 4.42 0.00 2.92 2.92 0.00 0.00 7.13 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 28 Q 8.06 3.93 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 29 M 7.77 3.71 0.00 0.91 1.22 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.58 0.00 30 M 8.14 4.05 0.00 1.78 1.97 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 2.50 0.00 31 K 7.69 3.92 0.00 1.84 1.90 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 32 S 8.02 4.18 0.00 3.82 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 33 R 7.76 4.32 0.00 1.91 2.05 0.00 3.60 0.00 0.00 3.20 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 34 N 7.91 4.29 0.00 2.90 2.94 0.00 0.00 6.90 7.17 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 35 L 7.94 4.33 0.00 1.81 1.64 0.83 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.57 5.29 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 1.39 0.00 0.00 37 K 8.35 4.17 0.00 1.78 1.92 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 D 7.87 4.74 0.00 2.68 2.64 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 39 R 7.23 3.92 0.00 1.79 1.76 0.00 2.92 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 40 C 8.74 4.89 0.00 3.09 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 41 K 8.00 4.29 0.00 1.80 1.78 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.61 1.39 7.81 42 P 0.00 4.78 0.00 2.20 2.32 0.00 3.76 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 43 V 7.60 5.11 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 0.71 0.00 0.00 0.95 0.00 0.00 44 N 8.83 4.73 0.00 2.57 2.25 0.00 0.00 7.12 6.80 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 45 T 7.71 4.89 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 0.91 0.00 0.00 46 F 8.97 4.85 0.00 2.96 2.83 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 47 V 8.91 4.57 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 1.15 0.00 0.00 1.00 0.00 0.00 48 H 8.64 5.48 0.00 3.14 3.41 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.69 4.80 0.00 1.95 1.84 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 2.26 2.28 0.00 50 S 8.39 4.34 0.00 4.07 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 51 L 8.56 4.00 0.00 1.83 1.75 1.03 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.00 4.21 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 53 D 7.93 4.35 0.00 2.87 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 54 V 7.76 3.79 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 1.25 0.00 0.00 1.07 0.00 0.00 55 Q 8.58 3.91 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.07 4.06 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.62 3.43 2.11 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 1.00 0.00 0.00 0.99 0.00 0.00 58 C 7.72 3.75 0.00 2.85 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.55 4.62 0.00 3.92 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 60 Q 7.37 4.25 0.00 1.69 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.91 0.00 0.00 0.00 0.00 0.00 1.98 2.24 0.00 61 K 8.08 4.28 0.00 1.95 1.80 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.43 7.81 62 N 8.81 4.48 0.00 2.77 2.65 0.00 0.00 7.00 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 63 V 8.39 4.59 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 0.66 0.00 0.00 0.86 0.00 0.00 64 A 8.40 4.29 1.19 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 0.00 0.00 65 C 9.00 4.68 0.00 3.06 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 66 K 9.20 3.72 0.00 1.70 1.89 0.00 1.90 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.56 7.81 67 N 8.10 4.60 0.00 2.81 2.90 0.00 0.00 6.26 7.00 0.00 0.00 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 G 8.17 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 69 Q 8.34 4.18 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 70 T 8.32 4.55 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 1.23 0.00 0.00 71 N 7.99 4.98 0.00 2.94 3.14 0.00 0.00 6.08 7.68 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 72 C 7.43 5.35 0.00 2.88 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 73 Y 8.71 5.04 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 74 Q 9.09 5.15 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 S 8.71 4.49 0.00 3.93 3.85 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 76 Y 9.08 4.51 0.00 3.04 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 77 S 7.83 5.06 0.00 3.93 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 78 T 8.28 4.24 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 1.01 0.00 0.00 79 M 8.89 5.06 0.00 1.96 2.00 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 2.54 2.49 0.00 80 S 9.34 4.86 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 81 I 8.91 5.22 1.94 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 1.37 0.82 1.04 0.00 0.00 82 T 8.90 5.06 4.43 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 0.00 0.00 0.00 1.34 0.00 0.00 83 D 9.10 5.10 0.00 2.81 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.29 5.65 0.00 2.86 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 85 R 8.89 5.30 0.00 1.98 1.77 0.00 3.19 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 86 E 9.11 4.19 0.00 2.11 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 2.14 1.94 0.00 87 T 8.45 4.41 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 1.17 0.00 0.00 88 G 8.68 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 89 S 7.39 4.44 0.00 3.89 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 90 S 7.57 4.19 0.00 3.82 3.76 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 91 K 8.72 4.33 0.00 1.80 1.60 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.40 7.81 92 Y 8.79 4.24 0.00 2.95 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 93 P 0.00 3.33 0.00 1.79 1.20 0.00 3.66 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 94 N 7.85 4.63 0.00 2.85 2.76 0.00 0.00 6.98 7.34 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 95 C 7.83 4.57 0.00 3.14 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 96 A 8.18 5.08 1.11 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 0.00 0.00 97 Y 9.18 5.07 0.00 2.99 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 98 K 9.27 4.45 0.00 1.84 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.09 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 1.29 0.00 0.00 100 T 8.83 4.69 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 0.00 101 Q 8.80 4.81 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 102 A 8.72 4.66 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 0.00 103 N 8.63 5.38 0.00 2.54 2.73 0.00 0.00 6.68 7.61 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 0.00 104 K 8.86 4.77 0.00 1.73 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 8.87 4.81 0.00 3.09 3.23 0.00 5.59 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.36 4.81 1.78 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 1.27 0.73 1.12 0.00 0.00 107 I 8.07 4.89 1.68 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 1.14 0.71 0.80 0.00 0.00 108 V 8.63 4.80 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 0.67 0.00 0.00 0.82 0.00 0.00 109 A 8.76 5.06 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 0.00 110 C 8.66 5.21 0.00 1.97 1.65 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 0.00 111 E 8.64 4.76 0.00 1.85 1.80 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 2.26 2.24 0.00 112 G 9.79 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 0.00 0.00 0.00 113 N 8.13 5.07 0.00 2.64 2.70 0.00 0.00 6.92 7.69 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 0.00 114 P 0.00 4.32 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.31 4.94 0.00 2.81 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 0.00 116 V 8.17 4.45 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 0.71 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.52 0.00 0.49 1.23 0.00 3.33 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 118 V 8.55 4.47 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 0.58 0.00 0.00 0.96 0.00 0.00 119 H 7.92 5.03 0.00 3.28 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.80 4.59 0.00 2.70 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 0.00 121 D 8.51 4.58 0.00 2.62 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 0.00 122 A 6.70 4.65 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.83 5.19 0.00 4.02 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 0.00 124 V 8.56 4.15 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 0.66 0.00 0.00 0.93 0.00 0.00