NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7045 8.4249 118.1228 53.1672 39.9974 173.8233 3 T 3.7084 8.3351 120.1481 62.1036 69.1449 172.1700 4 K 4.3866 8.9759 128.4008 54.7863 34.3875 174.8016 5 Y 4.5792 8.1649 124.2006 56.6720 39.4150 175.6149 6 N 4.3593 8.7897 121.0142 54.4087 40.8235 175.9308 7 K 3.9861 8.6492 126.9158 59.4674 32.6235 179.2939 8 K 3.9053 8.1624 118.4135 59.4311 31.8687 178.9111 9 F 4.2275 8.4708 120.7696 61.2818 39.2842 177.3513 10 L 3.6797 7.9033 118.3131 57.4237 41.4577 179.6087 11 L 3.6141 7.3853 118.8556 57.7297 41.6033 178.6306 12 Y 3.9432 7.6785 119.0802 60.7830 38.6977 177.9568 13 L 3.9275 8.0988 121.1504 58.1742 42.1033 178.7243 14 A 4.1045 8.2631 121.0211 55.1574 18.2797 179.8983 15 G 3.4459 7.8959 103.8981 47.7567 0.0000 175.8483 16 F 3.7927 7.8813 123.0352 60.8296 39.4112 177.5618 17 V 3.6503 8.6567 118.3752 66.2383 31.1853 177.8197 18 D 4.5351 8.1629 117.4960 56.9833 40.5955 178.3046 19 G 3.6013 7.5028 105.6191 46.1863 0.0000 173.9873 20 D 4.7001 8.7129 119.6426 53.1408 42.8114 175.9726 21 G 4.4580 7.8011 107.0673 45.4044 0.0000 173.2396 22 S 4.7299 8.6589 113.0795 57.1930 66.2854 173.1676 23 I 5.0777 8.6240 127.9902 59.7548 38.9473 174.7015 24 I 4.8035 8.9558 127.2441 58.9934 41.3537 173.8378 25 A 5.3741 8.7402 129.2429 50.3970 21.9201 175.2855 26 Q 4.6342 9.1064 118.9307 54.2413 33.8003 174.2441 27 I 4.8979 8.4820 122.6501 59.8597 39.5593 174.6346 28 N 4.9645 9.0878 125.9412 50.6488 40.4788 173.0075 29 P 4.6314 0.0000 0.0000 63.0814 32.2052 175.4821 30 N 4.8223 9.2818 125.4274 52.5000 41.5022 175.5054 31 Q 4.0413 9.1546 125.5399 58.1284 28.4720 174.5802 32 S 4.3301 8.1245 111.9832 60.6644 63.8540 175.1472 33 S 4.0950 7.9380 116.2702 58.2818 63.2334 174.8725 34 K 3.5252 8.5680 125.0831 59.2954 31.4024 177.9514 35 F 4.7440 7.5608 118.1791 57.7389 39.3672 177.5703 36 K 4.2140 8.2829 119.2512 54.9142 29.9601 177.3100 37 H 5.6126 7.8201 113.0608 55.3905 33.2681 172.7672 38 R 4.7964 9.2864 121.6097 54.5571 32.7733 174.6987 39 L 4.8931 8.7664 125.9596 54.5579 43.1348 176.4183 40 R 4.7021 9.0274 121.3782 54.4453 33.6284 174.0798 41 L 5.3271 8.6566 123.4798 53.2975 44.7830 175.6108 42 T 4.8559 8.9567 119.6653 61.7916 73.1127 172.4571 43 F 5.3691 9.1217 128.7286 56.9616 41.3960 173.9763 44 Y 4.9793 8.6837 123.7048 56.0164 41.6892 174.8391 45 V 4.6290 8.7513 122.3465 61.5525 34.4644 174.2659 46 T 4.9741 8.3033 124.6660 62.6024 70.0022 174.2841 47 Q 4.5821 9.0811 125.1368 54.3406 33.3439 173.1251 48 K 4.1571 8.8758 126.0543 57.4480 32.7390 177.5331 49 T 4.0715 8.9406 123.4229 66.5258 68.6908 176.2873 50 Q 4.0908 8.2402 121.4391 58.5002 29.3147 176.8649 51 R 4.5549 8.3191 117.0097 55.6628 30.9047 178.2864 52 R 3.8912 8.1692 121.3405 59.2358 29.8760 177.3852 53 W 4.5816 8.4063 116.1469 59.9825 27.4818 177.9168 54 F 3.4222 6.4334 120.0492 60.6597 39.0770 176.8527 55 L 4.0556 7.7084 118.1459 57.8370 41.6639 178.7858 56 D 4.4632 8.5016 119.2726 57.6466 40.8124 179.2702 57 K 4.0120 8.3602 118.8632 59.1907 31.9025 179.4601 58 L 3.7721 7.4133 119.1238 57.5112 41.4299 179.3591 59 V 3.7094 7.7398 117.7339 66.1533 31.1688 177.3965 60 D 4.2727 7.6723 115.7406 57.5900 41.2269 177.8198 61 E 3.9553 8.2800 118.0018 59.2627 29.4505 178.9749 62 I 3.9853 8.4731 119.8661 61.8346 37.0686 177.9043 63 G 4.0462 9.5270 107.0623 45.3113 0.0000 173.0539 64 V 4.3259 7.4099 117.1857 60.9183 34.3122 173.2980 65 G 3.8088 9.6086 106.6908 44.6832 0.0000 171.6137 66 Y 4.9821 7.8518 115.2260 55.2939 42.0086 174.2143 67 V 4.9388 8.5888 119.8182 61.0956 33.7805 174.7340 68 R 4.9061 8.9933 124.1671 54.5706 32.7922 174.1495 69 D 5.1893 8.8092 122.5073 53.6094 42.5184 177.9129 70 S 4.6179 9.1584 119.9064 55.4035 64.0691 171.4577 71 G 4.2301 8.1098 119.0805 45.4607 0.0000 172.0446 72 S 4.6138 8.6891 120.0614 57.7953 63.2915 173.1246 73 V 4.7902 7.3709 120.5644 61.6021 34.9384 174.4566 74 S 5.3679 9.1616 121.9874 56.9913 67.0650 172.9453 75 Q 5.0465 8.7500 119.1258 54.5785 33.2411 173.8389 76 Y 4.5660 9.0448 125.4673 57.2159 40.4104 174.2649 77 V 4.2051 7.5199 125.7246 60.6312 35.2330 173.7757 78 L 4.9694 8.5179 128.9919 53.4711 44.5351 176.6948 79 S 4.7911 8.7280 117.2190 56.2718 65.0008 174.1268 80 E 4.0329 8.2438 122.0049 56.7181 29.9120 177.2376 81 I 3.8205 8.9414 127.6774 65.5352 37.2381 178.7212 82 K 4.0071 8.1495 123.6573 59.6079 31.4490 178.7938 83 P 4.5492 0.0000 0.0000 65.3151 31.3447 178.6171 84 L 4.0332 8.1615 119.1176 58.3872 42.0467 178.3624 85 H 4.1075 8.6794 118.5893 59.3866 29.9243 176.5141 86 N 4.3001 8.4086 118.6916 56.7514 38.7922 176.4034 87 F 4.5063 8.6193 122.0268 61.5483 39.5065 176.9733 88 L 3.6453 8.2019 118.5834 58.0525 41.2160 179.5794 89 T 3.7225 7.6315 111.9711 64.9751 67.2602 175.7039 90 Q 4.1830 7.3917 118.2300 58.0033 29.1598 177.5999 91 L 4.0948 7.5114 121.9204 57.7299 41.8351 178.5989 92 Q 3.8776 8.1962 118.0823 59.0493 28.0158 177.2346 93 P 3.9920 0.0000 0.0000 64.5915 31.3541 177.6345 94 F 4.6435 7.5968 114.7942 57.2986 39.7116 176.3613 95 L 4.2467 7.0615 118.8147 54.7266 42.0243 175.5958 96 K 4.4483 9.3468 119.7885 58.2753 34.2850 178.2068 97 L 4.1511 8.1992 117.2478 56.8309 42.0528 178.1989 98 K 5.2072 8.0166 115.7025 55.0585 33.1181 177.6976 99 Q 4.0009 8.3698 125.2547 59.7161 28.8653 178.8762 100 K 3.9133 7.9885 124.1417 60.0199 31.9400 180.5603 101 Q 4.1995 8.1529 118.7828 58.7910 28.6106 178.9133 102 A 4.0321 8.0106 121.4923 55.4514 18.4457 179.5180 103 N 4.2329 8.2857 114.9039 56.3430 38.5778 177.7415 104 L 3.8649 8.3850 120.9205 57.6430 41.6218 179.7066 105 V 3.6613 8.1930 118.6263 66.0450 31.6202 178.0813 106 L 4.0842 8.3117 121.3600 58.3633 41.1826 180.3720 107 K 3.9617 7.8425 122.9029 59.5483 31.9552 181.4386 108 I 4.4361 7.9640 120.9198 64.4286 37.1232 178.3816 109 I 3.7629 7.9922 120.7266 64.7845 36.8471 178.4471 110 E 4.1027 8.0111 116.7908 58.5430 29.5867 178.1527 111 Q 4.4676 7.9854 118.1669 56.2082 29.6197 176.8928 112 L 4.0738 7.7206 120.2992 58.3621 41.5394 177.2376 113 P 4.3984 0.0000 0.0000 65.8713 31.6003 178.3886 114 S 4.3871 8.1503 111.5803 60.7268 63.1348 175.9748 115 A 4.1849 8.2078 126.1156 55.1276 18.1726 179.6475 116 K 4.4813 7.7879 122.2778 59.1101 32.0338 182.9378 117 E 4.2469 8.6532 116.6993 59.1524 29.6531 184.1318 118 S 4.6491 8.2949 115.7052 59.6681 65.4937 175.4281 119 P 3.5291 0.0000 0.0000 65.5583 31.0990 179.6851 120 D 4.3792 8.0478 122.3368 58.7990 39.7455 182.5906 121 K 4.0752 7.8713 124.7302 59.5122 31.6681 180.9387 122 F 4.1496 7.8507 121.8654 61.1278 39.0793 177.2945 123 L 3.6780 7.9300 117.8329 57.4131 41.5973 178.8631 124 E 3.6400 8.0419 119.6677 59.1475 29.6884 178.8851 125 V 2.4115 6.9791 118.0776 66.0235 31.5802 177.6866 126 C 3.8852 7.5828 116.5015 62.8620 27.8067 176.2312 127 T 4.1009 7.4035 111.3297 64.3352 68.5056 176.9008 128 W 4.4616 7.6233 121.5280 59.4531 28.9738 178.6490 129 V 3.6952 7.6901 118.1496 65.9688 30.9774 177.5180 130 D 4.3915 7.9369 118.3418 57.6104 40.6729 178.9357 131 Q 4.0216 8.0569 118.0444 58.8720 28.7062 178.7433 132 I 3.7256 7.7562 120.2052 64.4615 36.9734 178.4174 133 A 4.0593 7.8826 120.0522 54.9537 18.2056 179.2482 134 A 4.0946 7.9818 119.0737 55.3165 18.5398 179.6144 135 L 4.1211 7.9231 116.4324 56.5193 41.8804 177.4970 136 N 4.7022 7.2938 115.3508 52.4150 40.0575 175.3080 137 D 4.6539 8.1642 119.7557 53.6623 39.5347 177.2032 138 S 4.3271 7.6079 113.8923 58.2374 63.5870 173.5777 139 K 4.5839 8.6167 124.1176 56.6261 34.6917 176.7320 140 T 4.6468 7.6776 107.3743 60.9876 69.2929 173.5865 141 R 4.1082 8.1883 122.2824 57.2166 30.8473 174.7593 142 K 4.3553 8.7120 123.0376 58.2121 34.0507 176.5363 143 T 4.2993 7.7989 115.4347 62.7597 69.0923 174.0708 144 T 4.7674 8.2442 116.9996 59.0536 71.8985 174.7674 145 S 4.1569 8.5988 117.6472 62.0462 62.7564 176.9522 146 E 3.9555 7.9007 122.1921 61.0681 29.5927 183.0635 147 T 4.0245 7.8850 116.3030 66.7319 68.5675 176.4462 148 V 3.5262 7.6319 119.7576 65.9639 31.2721 177.7939 149 R 3.8344 7.8761 117.1270 59.6453 29.9858 177.9594 150 A 4.1186 8.2819 119.2638 55.0154 18.3251 179.6855 151 V 3.9090 7.4063 115.6131 65.3903 32.6163 178.0372 152 L 4.5641 7.6802 121.8685 54.1186 39.8086 175.2619 153 D 4.2741 8.2347 120.6699 53.9629 43.5310 176.0126 154 S 4.0557 8.8042 119.8564 59.0346 63.0786 172.6261 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 N 8.42 4.70 0.00 2.71 3.01 0.00 0.00 6.99 6.65 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 3 T 8.34 3.71 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 4 K 8.98 4.39 0.00 1.61 1.61 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.42 7.81 5 Y 8.16 4.58 0.00 3.27 3.07 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 6 N 8.79 4.36 0.00 2.77 2.79 0.00 0.00 6.79 5.97 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 7 K 8.65 3.99 0.00 1.92 1.79 0.00 1.89 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.36 1.46 7.81 8 K 8.16 3.91 0.00 2.16 1.88 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.51 7.81 9 F 8.47 4.23 0.00 3.15 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 10 L 7.90 3.68 0.00 1.62 1.68 1.22 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.39 3.61 0.00 1.66 1.58 0.82 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.68 3.94 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 13 L 8.10 3.93 0.00 1.25 1.43 0.99 1.11 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 14 A 8.26 4.10 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 15 G 7.90 3.45 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 0.00 16 F 7.88 3.79 0.00 2.91 3.13 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 17 V 8.66 3.65 2.29 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 1.23 0.00 0.00 1.43 0.00 0.00 18 D 8.16 4.54 0.00 2.75 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 19 G 7.50 3.60 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 0.00 0.00 0.00 20 D 8.71 4.70 0.00 2.03 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 21 G 7.80 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.66 4.73 0.00 3.86 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 23 I 8.62 5.08 1.98 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 1.56 1.03 1.02 0.00 0.00 24 I 8.96 4.80 2.01 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.58 1.32 0.00 0.00 25 A 8.74 5.37 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 26 Q 9.11 4.63 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 27 I 8.48 4.90 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.59 1.01 0.00 0.00 28 N 9.09 4.96 0.00 2.68 2.78 0.00 0.00 6.58 8.73 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 29 P 0.00 4.63 0.00 1.93 1.98 0.00 3.66 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 2.06 2.16 0.00 30 N 9.28 4.82 0.00 2.70 2.60 0.00 0.00 6.92 6.37 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 31 Q 9.15 4.04 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.88 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 32 S 8.12 4.33 0.00 3.94 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 33 S 7.94 4.10 0.00 3.93 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 34 K 8.57 3.53 0.00 1.33 1.27 0.00 0.94 0.00 0.00 0.76 0.00 0.00 2.72 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.87 7.81 35 F 7.56 4.74 0.00 2.30 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 36 K 8.28 4.21 0.00 1.85 1.88 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.26 1.23 7.81 37 H 7.82 5.61 0.00 3.31 3.40 0.00 5.76 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 9.29 4.80 0.00 1.85 1.80 0.00 3.12 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 39 L 8.77 4.89 0.00 1.69 1.66 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 40 R 9.03 4.70 0.00 1.75 1.84 0.00 3.28 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 1.59 1.78 0.00 41 L 8.66 5.33 0.00 1.63 1.62 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.96 4.86 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 0.39 0.00 0.00 43 F 9.12 5.37 0.00 3.20 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 44 Y 8.68 4.98 0.00 2.69 2.58 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 0.00 0.00 0.00 0.00 45 V 8.75 4.63 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 1.34 0.00 0.00 0.86 0.00 0.00 46 T 8.30 4.97 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 1.17 0.00 0.00 47 Q 9.08 4.58 0.00 2.21 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 48 K 8.88 4.16 0.00 1.86 1.69 0.00 1.78 0.00 0.00 1.94 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.52 7.81 49 T 8.94 4.07 4.27 0.00 0.00 0.00 0.00 0.00 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 50 Q 8.24 4.09 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.53 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 51 R 8.32 4.55 0.00 1.83 1.48 0.00 2.98 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 52 R 8.17 3.89 0.00 2.17 2.02 0.00 3.17 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 53 W 8.41 4.58 0.00 3.69 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.43 3.42 0.00 1.51 2.58 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 0.00 0.00 0.00 0.00 55 L 7.71 4.06 0.00 1.88 1.79 0.99 1.26 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 56 D 8.50 4.46 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 57 K 8.36 4.01 0.00 1.69 1.75 0.00 1.94 0.00 0.00 1.88 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.85 7.81 58 L 7.41 3.77 0.00 1.52 0.87 0.64 0.36 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 V 7.74 3.71 2.30 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 1.19 0.00 0.00 1.15 0.00 0.00 60 D 7.67 4.27 0.00 2.72 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 61 E 8.28 3.96 0.00 1.87 1.48 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 2.12 2.29 0.00 62 I 8.47 3.99 1.82 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.82 0.66 0.00 0.00 63 G 9.53 4.05 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 0.00 64 V 7.41 4.33 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 0.71 0.00 0.00 0.99 0.00 0.00 65 G 9.61 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 0.00 0.00 0.00 66 Y 7.85 4.98 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 67 V 8.59 4.94 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 0.92 0.00 0.00 1.06 0.00 0.00 68 R 8.99 4.91 0.00 2.04 2.23 0.00 3.10 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 69 D 8.81 5.19 0.00 2.58 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 70 S 9.16 4.62 0.00 3.57 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 71 G 8.11 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 0.00 0.00 0.00 0.00 72 S 8.69 4.61 0.00 4.02 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 73 V 7.37 4.79 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 1.03 0.00 0.00 0.92 0.00 0.00 74 S 9.16 5.37 0.00 3.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.75 5.05 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 76 Y 9.04 4.57 0.00 3.05 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 77 V 7.52 4.21 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 0.32 0.00 0.00 0.62 0.00 0.00 78 L 8.52 4.97 0.00 1.69 1.60 0.94 0.75 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 79 S 8.73 4.79 0.00 4.03 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 80 E 8.24 4.03 0.00 2.10 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 2.43 2.38 0.00 81 I 8.94 3.82 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.95 0.96 0.00 0.00 82 K 8.15 4.01 0.00 1.76 1.78 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.11 7.81 83 P 0.00 4.55 0.00 2.22 2.22 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 84 L 8.16 4.03 0.00 1.99 1.98 1.11 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.68 4.11 0.00 3.24 3.53 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.41 4.30 0.00 2.98 3.10 0.00 0.00 6.92 7.32 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 87 F 8.62 4.51 0.00 3.19 3.23 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 88 L 8.20 3.65 0.00 1.80 1.64 0.99 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.63 3.72 4.06 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 1.18 0.00 0.00 90 Q 7.39 4.18 0.00 2.41 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 91 L 7.51 4.09 0.00 0.86 1.17 0.80 0.51 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 92 Q 8.20 3.88 0.00 2.25 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 93 P 0.00 3.99 0.00 0.88 1.72 0.00 3.50 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.90 0.00 94 F 7.60 4.64 0.00 3.01 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 95 L 7.06 4.25 0.00 1.73 1.66 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 96 K 9.35 4.45 0.00 1.75 1.79 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.52 7.81 97 L 8.20 4.15 0.00 1.78 1.72 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.02 5.21 0.00 1.99 1.80 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.30 7.81 99 Q 8.37 4.00 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 100 K 7.99 3.91 0.00 1.80 1.81 0.00 1.86 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.45 1.11 7.81 101 Q 8.15 4.20 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 102 A 8.01 4.03 1.38 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 0.00 0.00 0.00 103 N 8.29 4.23 0.00 2.89 2.79 0.00 0.00 7.08 6.34 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 0.00 104 L 8.39 3.86 0.00 1.77 1.73 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.19 3.66 2.35 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 1.17 0.00 0.00 1.01 0.00 0.00 106 L 8.31 4.08 0.00 2.01 1.67 0.89 0.67 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 0.00 107 K 7.84 3.96 0.00 1.87 1.72 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.35 7.81 108 I 7.96 4.44 2.15 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 1.96 1.32 1.04 0.00 0.00 109 I 7.99 3.76 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.10 0.96 0.00 0.00 110 E 8.01 4.10 0.00 2.07 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 2.36 2.36 0.00 111 Q 7.99 4.47 0.00 2.72 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.74 0.00 0.00 0.00 0.00 0.00 2.72 2.59 0.00 112 L 7.72 4.07 0.00 2.14 1.79 1.09 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.40 0.00 2.06 2.17 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 114 S 8.15 4.39 0.00 4.10 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 0.00 115 A 8.21 4.18 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.79 4.48 0.00 1.97 1.73 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.32 7.81 117 E 8.65 4.25 0.00 1.99 1.67 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 0.00 2.25 2.12 0.00 118 S 8.29 4.65 0.00 3.73 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 0.00 119 P 0.00 3.53 0.00 2.00 1.78 0.00 3.54 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 120 D 8.05 4.38 0.00 2.68 2.67 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 0.00 0.00 0.00 0.00 121 K 7.87 4.08 0.00 1.75 1.85 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.07 7.81 122 F 7.85 4.15 0.00 3.02 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 0.00 123 L 7.93 3.68 0.00 1.68 1.57 0.86 0.81 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 0.00 124 E 8.04 3.64 0.00 1.79 1.66 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 1.47 1.82 0.00 125 V 6.98 2.41 1.77 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 0.90 0.00 0.00 0.69 0.00 0.00 126 C 7.58 3.89 0.00 2.83 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 0.00 127 T 7.40 4.10 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 1.10 0.00 0.00 128 W 7.62 4.46 0.00 3.60 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 0.00 129 V 7.69 3.70 2.24 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 1.09 0.00 0.00 0.95 0.00 0.00 130 D 7.94 4.39 0.00 2.99 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 0.00 131 Q 8.06 4.02 0.00 2.35 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 132 I 7.76 3.73 2.06 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 1.50 1.23 0.99 0.00 0.00 133 A 7.88 4.06 1.38 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 0.00 0.00 0.00 134 A 7.98 4.09 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 0.00 135 L 7.92 4.12 0.00 1.79 1.75 0.95 0.84 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 0.00 136 N 7.29 4.70 0.00 2.73 2.76 0.00 0.00 7.04 8.84 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 0.00 137 D 8.16 4.65 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.61 4.33 0.00 3.94 3.77 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 0.00 139 K 8.62 4.58 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.56 7.81 140 T 7.68 4.65 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 1.20 0.00 0.00 141 R 8.19 4.11 0.00 1.80 1.88 0.00 3.21 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 142 K 8.71 4.36 0.00 1.77 1.82 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.59 7.81 143 T 7.80 4.30 4.45 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 1.31 0.00 0.00 144 T 8.24 4.77 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 1.26 0.00 0.00 145 S 8.60 4.16 0.00 3.91 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 0.00 146 E 7.90 3.96 0.00 1.99 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 0.00 2.24 2.22 0.00 147 T 7.89 4.02 4.45 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 1.27 0.00 0.00 148 V 7.63 3.53 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 0.71 0.00 0.00 149 R 7.88 3.83 0.00 1.97 2.12 0.00 3.31 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 150 A 8.28 4.12 1.38 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 0.00 0.00 0.00 151 V 7.41 3.91 2.35 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 0.94 0.00 0.00 1.02 0.00 0.00 152 L 7.68 4.56 0.00 1.67 1.66 0.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.23 4.27 0.00 2.63 2.58 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 0.00 0.00 0.00 0.00 154 S 8.80 4.06 0.00 3.98 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