NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2649 8.3144 120.1355 55.5500 33.5571 174.7805 2 E 3.7714 8.5915 120.8470 55.1914 29.8649 175.7235 3 T 4.2571 8.7276 118.3621 61.1065 72.2374 175.0618 4 A 3.9896 8.5014 123.2325 55.3632 18.5620 179.9202 5 A 4.1343 8.0166 118.5950 55.2617 18.4970 179.6017 6 A 4.0119 7.9091 119.4187 55.0777 18.3763 179.7621 7 K 4.0100 8.3708 118.4145 59.5524 32.2984 178.6928 8 F 4.0667 8.4200 120.9206 61.3864 39.2898 176.9006 9 E 4.0169 8.2871 117.7384 59.5340 29.0923 179.3834 10 R 3.8901 7.8956 117.3465 59.6077 30.2228 178.2769 11 Q 3.9427 8.1314 117.1594 58.2211 29.0084 176.4626 12 H 4.6224 7.9104 114.2013 54.1379 31.8237 173.5302 13 M 4.7062 7.8955 118.3548 54.0640 33.5720 176.4432 14 D 4.7357 9.1469 122.9515 52.9654 42.0413 175.5896 15 S 4.5250 8.5948 116.7143 59.0303 63.5264 175.2689 16 S 4.4839 8.0400 114.5447 59.2508 63.4688 174.1738 17 T 4.7409 7.4400 109.8400 60.1406 71.5363 173.9025 18 S 4.3117 8.4802 117.6962 60.1168 63.5533 173.9205 19 A 3.9103 6.9796 119.6865 50.7558 21.3493 175.5162 20 A 3.4119 8.3550 123.2433 52.1888 18.7186 178.0385 21 S 4.6011 8.3179 115.6331 58.1616 64.5960 173.5979 22 S 4.6033 7.4054 114.8186 57.2760 65.1287 175.6146 23 S 4.2446 8.6263 115.3503 61.0086 62.9205 174.9172 24 N 4.6313 8.1667 117.5951 54.0224 39.0625 176.0962 25 Y 4.0254 8.0706 120.1608 61.2060 38.6369 177.6427 26 C 4.2044 8.2357 116.4392 60.0678 39.6840 175.7211 27 N 4.4116 8.2720 117.5489 56.6704 38.1410 177.3496 28 Q 3.9448 8.0110 119.1625 59.2118 28.8426 178.6457 29 M 3.7288 7.7774 119.8808 58.3113 31.8206 178.7232 30 M 4.0484 8.1368 119.3178 58.0459 32.0503 178.7989 31 K 3.9019 7.6545 118.6246 59.8239 32.2880 179.2733 32 S 4.1743 7.8952 113.8555 61.0824 62.7509 175.9086 33 R 4.2887 7.7315 118.2555 55.4397 30.0297 176.0602 34 N 4.3202 7.8869 115.0344 54.5204 34.9882 175.2106 35 L 4.3060 7.9455 118.4596 55.9354 42.1496 178.3168 36 T 5.2154 7.5853 106.7694 60.4045 69.2716 175.0005 37 K 4.1764 8.3075 124.6936 59.6531 32.3949 177.3290 38 D 4.7262 7.9639 116.3574 55.4288 42.3462 176.1373 39 R 4.0120 7.2831 112.8922 55.0736 31.7218 174.5134 40 C 4.7500 8.6836 116.7363 55.9527 40.0509 173.9117 41 K 4.2484 8.0751 127.5204 55.7423 32.4673 175.1675 42 P 4.6374 0.0000 0.0000 65.5446 32.5728 176.4417 43 V 5.1050 7.5759 110.7552 60.0609 35.8054 174.0693 44 N 4.6961 8.8263 120.0296 53.0251 42.7126 173.1037 45 T 4.8741 7.7617 118.9114 61.6197 72.2483 172.7924 46 F 4.8735 8.9463 124.3493 55.6424 42.1425 174.6362 47 V 4.5703 8.8681 122.7568 61.0542 33.5426 175.7019 48 H 5.4652 8.6934 128.6375 53.8684 26.2533 173.3873 49 E 4.8075 7.6970 117.7167 53.2652 34.5639 176.5670 50 S 4.3392 8.3939 115.0148 58.3579 64.9360 175.0435 51 L 3.9990 8.5239 124.7317 58.4061 41.9403 179.1928 52 A 4.0431 8.0127 120.2160 55.3932 18.1352 179.2109 53 D 4.3526 7.9352 116.4463 57.3354 41.1341 178.9019 54 V 3.7982 7.7701 118.4875 66.0469 31.7318 178.1311 55 Q 3.9195 8.5894 118.0174 58.8229 28.4808 178.5894 56 A 4.0743 8.0612 121.3585 54.4024 18.3046 179.6300 57 V 3.4431 7.6422 117.1198 65.8990 31.3102 176.9450 58 C 3.6969 7.7030 114.5955 58.0371 39.9049 174.1587 59 S 4.6223 7.5294 114.1962 57.9998 63.8816 174.6315 60 Q 4.2955 7.4029 121.2427 56.1599 30.3903 177.5892 61 K 4.3247 8.3240 131.9488 56.5254 33.0010 175.1928 62 N 4.4989 8.7813 127.3137 53.5892 39.2570 174.3277 63 V 4.5891 8.3721 117.8319 59.3268 36.8579 174.5664 64 A 4.3191 8.3867 125.1770 52.0915 19.0341 178.5825 65 C 4.6955 8.9188 120.0551 56.2572 41.0769 175.2253 66 K 3.7581 9.1363 121.5283 59.5336 31.5601 178.1375 67 N 4.5802 8.0819 113.2396 52.7740 37.5887 175.7979 68 G 3.9561 8.1468 108.5366 45.4165 0.0000 174.3868 69 Q 4.1467 8.2679 119.1924 56.5379 29.1839 176.7759 70 T 4.4786 8.3350 109.1264 61.6445 69.2753 173.7354 71 N 4.9581 7.9859 118.3003 53.7441 38.6782 174.9533 72 C 5.3528 7.4296 116.2437 56.7982 44.3138 172.4720 73 Y 5.0908 8.7277 118.0706 56.4918 42.2057 173.8758 74 Q 5.1214 9.1184 125.5969 54.1482 31.3137 174.9288 75 S 4.5018 8.6866 121.6486 58.5576 63.2942 174.3306 76 Y 4.4607 8.9622 120.7602 60.3301 37.9537 176.2502 77 S 4.8719 7.8118 112.5400 56.1738 64.7702 173.2900 78 T 4.2091 8.0422 114.4498 61.9960 69.7015 173.3636 79 M 5.0462 8.9382 121.8070 53.4155 36.9706 174.5853 80 S 4.9065 9.2942 116.9701 58.1978 63.6082 173.1065 81 I 5.2301 8.8915 120.0699 59.4704 41.5973 174.1863 82 T 5.0759 8.8957 119.6593 61.9201 71.7367 172.5192 83 D 5.1213 9.1186 126.7264 53.1950 43.4265 174.2455 84 C 5.6893 9.2272 123.0531 55.2289 41.7091 172.9893 85 R 5.2831 8.8915 123.0015 54.1831 33.2930 173.8526 86 E 4.1500 9.1133 128.0178 56.8731 30.4464 176.5331 87 T 4.4003 8.4797 117.1693 60.1079 71.0223 176.0020 88 G 3.6360 8.6679 110.0442 48.1855 0.0000 174.6358 89 S 4.4419 7.4170 112.9209 58.5308 63.2751 174.4230 90 S 4.0702 7.6714 116.7810 57.9834 62.6988 173.6882 91 K 4.2886 8.6979 128.5045 55.2674 34.0945 174.2795 92 Y 4.2013 8.7903 127.8545 57.9823 38.8864 174.1767 93 P 3.3605 0.0000 0.0000 62.6635 32.5180 176.5643 94 N 4.6318 7.8295 119.9677 52.1819 36.9653 173.5244 95 C 4.5941 7.8311 116.4353 56.7761 42.4779 173.4614 96 A 5.0882 8.1412 124.6711 50.4393 22.1174 174.4944 97 Y 5.0625 9.1064 118.1838 56.0765 42.6098 174.7778 98 K 4.4646 9.2464 124.5098 55.9080 33.9725 175.2883 99 T 5.1377 8.5602 123.8497 62.5090 70.2647 174.1631 100 T 4.6494 8.8458 122.3966 61.8183 72.2329 172.7308 101 Q 4.9684 8.7794 127.0235 54.9409 30.9855 174.0561 102 A 4.7446 8.7860 125.4667 50.8910 23.6947 174.9058 103 N 5.4176 8.6674 115.4670 51.7591 41.2753 174.2608 104 K 4.7725 8.8490 122.4174 54.7124 37.5094 175.8364 105 H 4.7889 8.8892 119.0541 55.9740 30.0344 174.6121 106 I 4.8196 8.3658 115.0292 59.3492 40.6936 174.4139 107 I 4.8824 8.0779 124.0762 59.7248 40.1375 175.0694 108 V 4.7886 8.6347 119.3737 59.3563 35.9539 174.3619 109 A 5.0673 8.7321 124.7251 50.9216 20.8279 175.6344 110 C 5.1937 8.6592 118.7932 55.3009 40.9787 173.2545 111 E 4.7331 8.5611 119.8319 55.9489 34.5091 175.5319 112 G 4.0091 9.6793 107.5513 44.9925 0.0000 171.8671 113 N 5.0183 8.1207 115.6024 50.7825 40.4081 172.1192 114 P 4.2872 0.0000 0.0000 62.7254 31.9970 175.9368 115 Y 4.8749 8.3586 123.2327 56.9638 39.0020 174.6944 116 V 4.4545 8.2141 119.5229 58.4819 36.6512 173.4706 117 P 4.5157 0.0000 0.0000 62.8787 31.1305 176.8953 118 V 4.4680 8.5681 115.6468 61.2116 33.9624 175.2805 119 H 5.0637 7.9007 119.8968 54.7264 33.5623 171.6332 120 F 4.6030 8.8036 127.8742 57.4258 39.4353 174.3979 121 D 4.5932 8.4481 126.9269 56.1183 41.8471 175.9185 122 A 4.6457 6.7095 117.0608 51.3321 22.4559 174.7587 123 S 5.2274 8.8308 113.4087 56.7825 65.9378 174.6565 124 V 4.1497 8.5330 114.3248 61.8186 32.1968 175.1239 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 4.26 0.00 1.77 1.85 0.00 1.74 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 1.44 7.81 2 E 8.59 3.77 0.00 2.01 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 2.32 2.38 0.00 3 T 8.73 4.26 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 8.50 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 8.02 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 7.91 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 7 K 8.37 4.01 0.00 1.86 2.03 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.42 4.07 0.00 3.17 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 8.29 4.02 0.00 2.31 2.04 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 2.49 2.68 0.00 10 R 7.90 3.89 0.00 1.80 2.08 0.00 3.38 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 1.66 0.00 11 Q 8.13 3.94 0.00 1.51 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 12 H 7.91 4.62 0.00 2.12 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 7.90 4.71 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 14 D 9.15 4.74 0.00 2.72 2.49 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 15 S 8.59 4.52 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 8.04 4.48 0.00 4.01 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 7.44 4.74 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 1.27 0.00 0.00 18 S 8.48 4.31 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 6.98 3.91 1.04 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 0.00 0.00 20 A 8.35 3.41 0.82 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 0.00 0.00 21 S 8.32 4.60 0.00 3.96 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 22 S 7.41 4.60 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 8.63 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 8.17 4.63 0.00 2.83 2.89 0.00 0.00 6.43 7.48 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 25 Y 8.07 4.03 0.00 3.13 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 26 C 8.24 4.20 0.00 3.17 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 27 N 8.27 4.41 0.00 2.91 2.92 0.00 0.00 7.12 7.63 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 28 Q 8.01 3.94 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 29 M 7.78 3.73 0.00 0.89 1.20 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 1.71 0.00 30 M 8.14 4.05 0.00 1.73 1.93 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 2.46 0.00 31 K 7.65 3.90 0.00 1.86 1.90 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 32 S 7.90 4.17 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 7.73 4.29 0.00 1.91 2.06 0.00 3.59 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.92 0.00 34 N 7.89 4.32 0.00 2.90 2.95 0.00 0.00 6.92 7.26 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 35 L 7.95 4.31 0.00 1.80 1.64 0.81 0.55 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 7.59 5.22 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 1.38 0.00 0.00 37 K 8.31 4.18 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 3.11 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 D 7.96 4.73 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 7.28 4.01 0.00 1.82 1.78 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 1.53 1.62 0.00 40 C 8.68 4.75 0.00 3.10 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 8.08 4.25 0.00 1.95 1.77 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.39 7.81 42 P 0.00 4.64 0.00 2.20 2.32 0.00 3.75 0.00 0.00 3.94 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 7.58 5.10 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 0.73 0.00 0.00 0.95 0.00 0.00 44 N 8.83 4.70 0.00 2.59 2.26 0.00 0.00 7.08 6.74 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 45 T 7.76 4.87 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 0.89 0.00 0.00 46 F 8.95 4.87 0.00 2.95 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 8.87 4.57 2.14 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 1.16 0.00 0.00 1.01 0.00 0.00 48 H 8.69 5.47 0.00 3.14 3.40 0.00 5.62 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 7.70 4.81 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 8.52 4.00 0.00 1.83 1.74 1.03 1.29 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 52 A 8.01 4.04 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 7.94 4.35 0.00 2.85 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 7.77 3.80 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 1.04 0.00 0.00 55 Q 8.59 3.92 0.00 2.30 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 2.43 0.00 56 A 8.06 4.07 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 7.64 3.44 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 0.99 0.00 0.00 0.98 0.00 0.00 58 C 7.70 3.70 0.00 2.86 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 7.53 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 7.40 4.30 0.00 1.70 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 2.04 2.26 0.00 61 K 8.32 4.32 0.00 1.99 1.82 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.43 7.81 62 N 8.78 4.50 0.00 2.77 2.64 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 8.37 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 0.69 0.00 0.00 0.82 0.00 0.00 64 A 8.39 4.32 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 8.92 4.70 0.00 3.07 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 66 K 9.14 3.76 0.00 1.71 1.88 0.00 1.91 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.55 7.81 67 N 8.08 4.58 0.00 2.81 2.91 0.00 0.00 6.27 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 8.15 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 69 Q 8.27 4.15 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 70 T 8.34 4.48 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 4.96 0.00 3.05 3.14 0.00 0.00 6.09 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 2.78 2.90 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 0.00 0.00 0.00 0.00 73 Y 8.73 5.09 0.00 2.81 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 74 Q 9.12 5.12 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 75 S 8.69 4.50 0.00 3.92 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 76 Y 8.96 4.46 0.00 3.04 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 77 S 7.81 4.87 0.00 3.88 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 8.04 4.21 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 1.02 0.00 0.00 79 M 8.94 5.05 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 9.29 4.91 0.00 3.91 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 81 I 8.89 5.23 1.89 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 1.05 0.00 0.00 82 T 8.90 5.08 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 1.29 0.00 0.00 83 D 9.12 5.12 0.00 2.73 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 9.23 5.69 0.00 2.89 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 85 R 8.89 5.28 0.00 1.99 1.77 0.00 3.19 0.00 0.00 3.14 7.18 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 4.15 0.00 2.12 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 2.13 1.93 0.00 87 T 8.48 4.40 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 8.67 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 89 S 7.42 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 7.67 4.07 0.00 3.83 3.75 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 91 K 8.70 4.29 0.00 1.81 1.60 0.00 1.72 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 4.20 0.00 2.97 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 0.00 93 P 0.00 3.36 0.00 1.80 1.27 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 1.73 1.75 0.00 94 N 7.83 4.63 0.00 2.90 2.76 0.00 0.00 7.00 7.18 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 95 C 7.83 4.59 0.00 3.14 3.05 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 96 A 8.14 5.09 1.12 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 0.00 0.00 97 Y 9.11 5.06 0.00 2.98 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 9.25 4.46 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 5.14 4.31 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 1.28 0.00 0.00 100 T 8.85 4.65 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 1.23 0.00 0.00 101 Q 8.78 4.97 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.78 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 102 A 8.79 4.74 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 8.67 5.42 0.00 2.55 2.73 0.00 0.00 6.69 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 8.85 4.77 0.00 1.73 1.69 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 8.89 4.79 0.00 3.08 3.23 0.00 5.59 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.37 4.82 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 0.66 1.12 0.00 0.00 107 I 8.08 4.88 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 0.74 0.83 0.00 0.00 108 V 8.63 4.79 1.96 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 0.66 0.00 0.00 0.81 0.00 0.00 109 A 8.73 5.07 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 8.66 5.19 0.00 1.94 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 0.00 0.00 0.00 111 E 8.56 4.73 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 2.25 2.22 0.00 112 G 9.68 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 8.12 5.02 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 4.29 0.00 2.09 1.98 0.00 3.74 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 2.03 2.08 0.00 115 Y 8.36 4.87 0.00 2.75 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 0.00 116 V 8.21 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 0.72 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.52 0.00 0.49 1.23 0.00 3.34 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 1.62 1.77 0.00 118 V 8.57 4.47 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 0.58 0.00 0.00 0.96 0.00 0.00 119 H 7.90 5.06 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 4.60 0.00 2.71 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 0.00 121 D 8.45 4.59 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 0.00 122 A 6.71 4.65 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 0.00 123 S 8.83 5.23 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 8.53 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 0.64 0.00 0.00 0.93 0.00 0.00