NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2278 8.3144 121.7900 55.6142 33.6024 175.1844 2 E 3.8163 8.5573 125.8596 54.9072 30.1941 175.1590 3 T 4.2855 8.7186 118.1137 61.2351 72.1044 175.0465 4 A 4.0095 8.5392 123.6533 55.3394 18.4518 179.9221 5 A 4.1313 8.0408 118.5500 55.4187 18.4849 179.6215 6 A 4.0259 8.2139 119.2865 55.0149 18.3812 179.7146 7 K 4.0852 8.4621 120.0205 59.0007 32.2781 178.6667 8 F 4.1105 8.4850 120.9454 61.5138 39.3108 176.9610 9 E 4.0337 8.4486 118.1383 59.3767 29.0233 179.3991 10 R 3.8663 7.9567 117.8177 59.6086 30.2950 178.2949 11 Q 3.9918 8.1133 116.6809 58.0030 29.0761 176.2866 12 H 4.7099 7.8782 113.7463 53.6640 31.6660 172.9919 13 M 4.7165 7.9148 118.7143 53.7253 33.5468 176.4338 14 D 4.7662 9.0883 123.5776 52.8688 41.4058 175.7529 15 S 4.4616 9.0509 117.7457 60.1995 63.7459 176.5841 16 S 4.1189 7.5333 114.6318 61.0606 63.0157 174.4609 17 T 4.6487 7.4142 116.0758 60.4026 71.2532 174.5169 18 S 4.2443 8.4645 116.4216 60.7170 63.5068 173.9079 19 A 4.3118 7.1643 120.9793 50.5067 21.6651 175.1743 20 A 3.4788 7.9212 123.1429 51.4239 19.5137 176.6619 21 S 4.0253 8.5810 121.1819 59.9144 62.4971 176.1798 22 S 4.6106 8.5725 119.2873 57.3293 65.1318 176.1204 23 S 4.2131 8.5082 114.9122 60.8871 62.8328 174.5809 24 N 4.6229 7.9108 117.9784 53.9800 39.2820 175.5194 25 Y 4.0665 8.1499 119.2134 62.1461 38.6941 177.6167 26 C 4.1334 8.4404 116.9217 59.9321 39.0378 175.6712 27 N 4.3824 8.2519 117.6184 56.5563 38.1893 177.0524 28 Q 3.8660 7.9245 120.5704 59.4440 29.1736 178.1531 29 M 3.7399 7.6932 121.3311 57.9256 31.7742 178.6251 30 M 4.0024 8.1336 119.2670 58.0557 31.9996 178.8522 31 K 3.9286 7.6709 119.1782 59.6239 32.1200 179.2279 32 S 4.2084 8.1325 114.1736 60.5947 62.6133 175.4166 33 R 4.4825 7.5848 119.7551 54.9991 30.2869 175.5914 34 N 4.2393 7.9813 114.8303 54.8579 36.4146 174.8331 35 L 4.5766 8.2472 116.3750 54.9082 42.3502 177.9256 36 T 4.8730 7.6355 106.6473 60.0759 69.2966 173.5987 37 K 4.1873 8.1417 123.8396 57.3832 32.7569 177.4212 38 D 4.4012 9.4438 124.8590 54.0117 40.0132 173.5969 39 R 3.8211 6.8180 112.6774 54.7614 31.7425 174.5752 40 C 4.6847 8.5911 117.4102 55.9914 40.1988 173.7684 41 K 4.1353 8.5821 127.6089 55.9830 32.2789 174.8124 42 P 4.6925 0.0000 0.0000 65.0991 32.4984 176.7193 43 V 4.9524 7.5916 117.4623 61.1570 34.4955 174.3847 44 N 4.7225 9.2491 125.2500 52.7569 42.8856 172.8163 45 T 4.7553 7.9457 122.0347 61.7796 71.2687 173.1722 46 F 4.8618 8.8784 124.6753 55.6674 42.0383 174.6440 47 V 4.5708 8.9878 122.8172 61.6945 33.4752 175.5076 48 H 5.6267 9.1327 123.8662 55.3130 29.9583 175.2370 49 E 4.3421 8.0932 118.4673 55.2237 30.5394 177.0208 50 S 4.3432 8.3325 115.0495 58.2626 64.9377 174.8347 51 L 3.9813 7.9195 122.0582 58.4700 41.8268 179.2793 52 A 4.0067 8.0736 120.0139 55.5714 18.0825 179.2461 53 D 4.3402 7.9808 115.9274 57.3830 41.1702 178.9617 54 V 3.7810 7.9972 118.8406 66.1580 31.7027 178.1517 55 Q 3.9217 8.6077 118.0068 58.8245 28.4606 178.6339 56 A 4.0405 8.1049 121.5103 54.5881 18.2687 179.6266 57 V 3.4258 7.6710 117.0239 65.9795 31.2854 176.8430 58 C 3.8252 7.7441 114.3955 57.7925 39.9281 174.0650 59 S 4.6911 7.5364 114.5305 57.9854 63.8784 174.3027 60 Q 4.0976 7.2743 120.0460 56.2673 30.6170 178.5670 61 K 4.3512 8.5420 135.0000 56.3088 32.7034 174.5419 62 N 4.2495 8.7554 127.5336 53.7293 39.5934 174.3481 63 V 4.5875 8.4327 118.2278 59.1860 36.6461 175.0042 64 A 4.3127 8.4329 124.9902 52.4083 19.0903 178.4123 65 C 4.7678 8.7607 118.6124 55.7643 41.4395 175.2805 66 K 3.7211 9.0158 121.9233 59.7424 31.6360 178.0885 67 N 4.5140 8.0357 112.9150 53.0832 37.6274 175.8054 68 G 3.9452 8.1309 108.5208 45.4499 0.0000 174.2230 69 Q 4.1700 8.5754 119.5158 56.4329 29.1875 176.7054 70 T 4.4591 8.3362 108.6153 61.6653 69.2480 174.1653 71 N 5.0482 7.8234 119.1844 53.5424 38.5583 174.9433 72 C 5.2951 7.5089 115.5740 56.9335 44.1646 172.6361 73 Y 5.0359 8.8728 118.6246 56.4317 42.1839 173.9341 74 Q 5.0095 9.1683 125.8992 54.1850 31.1697 174.8864 75 S 4.5258 8.8017 122.1427 58.7352 63.0663 174.2818 76 Y 4.5166 9.1001 121.9658 60.7688 37.9326 176.8558 77 S 4.8189 7.8587 114.0107 56.9318 64.7924 173.8437 78 T 4.1488 8.0322 112.5730 62.1294 69.6851 173.5205 79 M 5.0248 8.9146 121.9962 53.3281 36.8014 174.7460 80 S 4.7673 9.5532 117.8542 58.4776 63.5404 173.1164 81 I 5.1204 8.9733 120.0333 59.5312 41.8088 174.0635 82 T 4.9951 8.9605 118.9903 61.9444 71.9392 172.8870 83 D 4.9701 9.2928 127.0410 53.4215 42.8130 174.7038 84 C 5.4937 9.1571 121.5059 55.2190 44.2080 172.9915 85 R 5.2219 8.7872 123.3897 54.1508 33.1039 173.9300 86 E 4.0884 9.5206 128.2518 56.5598 30.2529 176.8776 87 T 4.1956 8.4810 116.2615 61.0085 69.6940 175.8479 88 G 3.6514 8.5560 110.9887 47.5664 0.0000 174.4482 89 S 4.5638 7.2875 111.7290 57.8050 63.7778 174.4386 90 S 4.0947 7.4927 117.3940 58.2285 62.8905 173.3866 91 K 4.3905 8.3670 126.7887 54.6438 34.0828 174.6239 92 Y 4.3336 8.8491 127.5226 57.8139 38.9410 175.2785 93 P 3.1814 0.0000 0.0000 64.1667 32.4307 176.8609 94 N 4.6141 7.5950 118.8391 52.1270 36.8631 172.6534 95 C 4.3926 8.0249 117.2103 56.5473 42.6896 173.2229 96 A 5.1106 8.5537 125.3918 50.3879 22.0650 174.4342 97 Y 5.1482 9.1519 118.4029 56.1235 42.1773 175.2196 98 K 4.5064 9.0022 122.3930 55.9603 34.0668 175.7528 99 T 5.0171 8.5521 121.1544 62.4782 70.2903 174.2064 100 T 4.6096 8.8210 122.8526 61.6772 71.8589 173.5454 101 Q 4.6921 8.8307 125.7459 56.0229 29.7921 175.2524 102 A 4.6576 8.9311 123.3945 50.9565 23.7204 174.7619 103 N 5.2936 8.6354 116.7079 52.1719 41.1647 173.3273 104 K 4.7910 8.8033 124.7202 54.8507 37.7200 175.5350 105 H 4.8001 9.1960 119.6381 55.9618 29.8020 175.0448 106 I 4.7574 8.5326 116.0993 59.5612 40.5178 174.4740 107 I 4.9265 8.1992 124.2095 59.7143 40.2517 175.0740 108 V 4.7952 8.6556 119.2708 59.3033 36.1875 174.5128 109 A 4.9012 8.7317 125.2011 51.4673 20.1943 175.7942 110 C 5.1015 8.6675 119.4122 55.2529 37.2830 173.1024 111 E 4.6556 8.7010 121.3422 56.3737 33.7362 175.2406 112 G 4.2042 9.4736 110.1146 44.7263 0.0000 171.6744 113 N 4.7816 8.1343 116.0913 50.5920 40.1380 172.1726 114 P 4.3427 0.0000 0.0000 62.7398 32.0112 176.0376 115 Y 5.1233 8.2367 121.3653 56.6813 38.5868 174.4672 116 V 4.4364 8.0425 118.8111 58.2572 36.7933 173.4035 117 P 4.4480 0.0000 0.0000 63.0132 31.0989 176.9809 118 V 4.4455 8.6113 115.5302 61.1876 33.7423 175.1854 119 H 4.9695 7.7839 119.3915 55.0428 33.3835 171.7329 120 F 4.6682 8.7914 128.0100 57.3830 39.5277 174.4292 121 D 4.5956 8.4462 126.9420 56.0998 41.9198 175.9235 122 A 4.5781 6.4940 117.0601 51.4255 22.3643 174.8407 123 S 5.2554 8.9107 113.5245 56.6942 65.9401 174.6550 124 V 4.1505 8.8900 114.8877 61.7241 32.5730 175.3627 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 4.23 0.00 1.74 1.79 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.56 3.82 0.00 2.13 1.83 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 2.40 2.38 0.00 3 T 8.72 4.29 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 1.23 0.00 0.00 4 A 8.54 4.01 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 8.04 4.13 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 8.21 4.03 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 7 K 8.46 4.09 0.00 2.01 2.03 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.49 4.11 0.00 3.26 3.28 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 0.00 9 E 8.45 4.03 0.00 2.28 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 2.53 2.69 0.00 10 R 7.96 3.87 0.00 1.81 2.09 0.00 3.37 0.00 0.00 3.22 7.55 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 8.11 3.99 0.00 1.52 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.49 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 12 H 7.88 4.71 0.00 1.91 2.58 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.91 4.72 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.64 0.00 14 D 9.09 4.77 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 9.05 4.46 0.00 3.93 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 16 S 7.53 4.12 0.00 3.98 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 17 T 7.41 4.65 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 1.18 0.00 0.00 18 S 8.46 4.24 0.00 3.96 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 19 A 7.16 4.31 1.13 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 20 A 7.92 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.58 4.03 0.00 3.90 3.69 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 0.00 0.00 0.00 0.00 22 S 8.57 4.61 0.00 4.02 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 23 S 8.51 4.21 0.00 4.03 4.08 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 4.62 0.00 2.87 2.85 0.00 0.00 6.61 7.44 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 25 Y 8.15 4.07 0.00 3.16 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 0.00 26 C 8.44 4.13 0.00 3.15 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 27 N 8.25 4.38 0.00 3.01 2.93 0.00 0.00 6.75 7.58 0.00 0.00 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 7.92 3.87 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 29 M 7.69 3.74 0.00 0.89 1.30 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.38 0.00 30 M 8.13 4.00 0.00 1.68 1.83 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.31 0.00 31 K 7.67 3.93 0.00 1.95 1.91 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 32 S 8.13 4.21 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 33 R 7.58 4.48 0.00 1.87 2.13 0.00 3.59 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.98 0.00 34 N 7.98 4.24 0.00 2.89 2.93 0.00 0.00 6.80 7.22 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 35 L 8.25 4.58 0.00 1.78 1.63 0.78 0.77 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 36 T 7.64 4.87 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 37 K 8.14 4.19 0.00 1.78 1.78 0.00 1.98 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.40 7.81 38 D 9.44 4.40 0.00 2.86 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 39 R 6.82 3.82 0.00 1.85 1.71 0.00 2.97 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 40 C 8.59 4.68 0.00 3.07 3.14 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 41 K 8.58 4.14 0.00 1.81 1.78 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.42 7.81 42 P 0.00 4.69 0.00 2.15 2.10 0.00 3.62 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 2.13 2.10 0.00 43 V 7.59 4.95 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.25 4.72 0.00 2.63 2.26 0.00 0.00 6.72 7.90 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 45 T 7.95 4.76 2.92 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 0.95 0.00 0.00 46 F 8.88 4.86 0.00 3.02 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 47 V 8.99 4.57 2.15 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 1.13 0.00 0.00 1.03 0.00 0.00 48 H 9.13 5.63 0.00 3.18 3.54 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.09 4.34 0.00 2.01 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 2.36 2.28 0.00 50 S 8.33 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 7.92 3.98 0.00 1.90 1.75 1.03 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.07 4.01 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 7.98 4.34 0.00 2.84 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 54 V 8.00 3.78 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 1.24 0.00 0.00 1.07 0.00 0.00 55 Q 8.61 3.92 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 56 A 8.10 4.04 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 57 V 7.67 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 1.07 0.00 0.00 0.96 0.00 0.00 58 C 7.74 3.83 0.00 2.87 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 7.54 4.69 0.00 3.91 3.84 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 60 Q 7.27 4.10 0.00 1.66 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.97 0.00 0.00 0.00 0.00 0.00 1.73 2.14 0.00 61 K 8.54 4.35 0.00 2.08 1.85 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.50 7.81 62 N 8.76 4.25 0.00 2.69 2.63 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 8.43 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 0.70 0.00 0.00 0.81 0.00 0.00 64 A 8.43 4.31 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 8.76 4.77 0.00 3.11 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 0.00 66 K 9.02 3.72 0.00 1.91 1.90 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.39 7.81 67 N 8.04 4.51 0.00 2.79 2.90 0.00 0.00 6.24 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 8.13 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 8.58 4.17 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 70 T 8.34 4.46 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 1.18 0.00 0.00 71 N 7.82 5.05 0.00 3.08 3.15 0.00 0.00 6.11 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 7.51 5.30 0.00 3.08 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 73 Y 8.87 5.04 0.00 2.80 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 74 Q 9.17 5.01 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 75 S 8.80 4.53 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 76 Y 9.10 4.52 0.00 3.03 2.94 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 77 S 7.86 4.82 0.00 3.91 3.81 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 78 T 8.03 4.15 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 1.01 0.00 0.00 79 M 8.91 5.02 0.00 1.95 1.99 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 2.53 2.48 0.00 80 S 9.55 4.77 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 81 I 8.97 5.12 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 1.03 0.00 0.00 82 T 8.96 5.00 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 1.33 0.00 0.00 83 D 9.29 4.97 0.00 2.59 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 84 C 9.16 5.49 0.00 2.92 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 85 R 8.79 5.22 0.00 1.90 1.78 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.52 4.09 0.00 1.88 1.76 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 2.14 1.96 0.00 87 T 8.48 4.20 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 1.22 0.00 0.00 88 G 8.56 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 7.29 4.56 0.00 4.03 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 90 S 7.49 4.09 0.00 3.76 3.80 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 91 K 8.37 4.39 0.00 1.81 1.59 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.85 4.33 0.00 3.06 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 93 P 0.00 3.18 0.00 1.86 1.41 0.00 3.67 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 94 N 7.60 4.61 0.00 2.86 2.77 0.00 0.00 6.86 6.96 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 95 C 8.02 4.39 0.00 3.13 3.09 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 96 A 8.55 5.11 1.13 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 97 Y 9.15 5.15 0.00 2.97 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 9.00 4.51 0.00 1.75 1.77 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.58 7.81 99 T 8.55 5.02 4.33 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 1.30 0.00 0.00 100 T 8.82 4.61 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 8.83 4.69 0.00 1.92 2.00 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 2.26 2.32 0.00 102 A 8.93 4.66 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 0.00 103 N 8.64 5.29 0.00 2.69 2.70 0.00 0.00 6.75 6.68 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 0.00 104 K 8.80 4.79 0.00 1.78 1.85 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.20 4.80 0.00 3.16 3.34 0.00 5.60 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.53 4.76 1.80 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.21 1.13 0.00 0.00 107 I 8.20 4.93 1.67 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 1.15 0.70 0.84 0.00 0.00 108 V 8.66 4.80 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 0.72 0.00 0.00 0.84 0.00 0.00 109 A 8.73 4.90 1.24 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 0.00 0.00 110 C 8.67 5.10 0.00 2.10 1.69 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 0.00 0.00 0.00 0.00 111 E 8.70 4.66 0.00 1.96 1.68 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 2.25 2.30 0.00 112 G 9.47 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 0.00 0.00 0.00 113 N 8.13 4.78 0.00 2.66 2.72 0.00 0.00 6.91 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 4.34 0.00 2.23 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 8.24 5.12 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 0.00 116 V 8.04 4.44 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 0.71 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.45 0.00 0.49 0.93 0.00 3.33 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 118 V 8.61 4.45 2.08 0.00 0.00 0.00 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 0.91 0.00 0.00 119 H 7.78 4.97 0.00 3.21 3.10 0.00 5.65 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 8.79 4.67 0.00 2.72 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 8.45 4.60 0.00 2.60 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 0.00 122 A 6.49 4.58 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 8.91 5.26 0.00 4.04 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 0.00 124 V 8.89 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