NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.3013 8.3144 121.7932 56.6433 33.3563 176.3017 4 C 4.9995 8.1945 121.6889 52.5997 43.4335 171.4821 5 S 4.5249 8.8110 118.6589 57.2073 64.0838 173.6442 6 L 4.1487 8.0870 124.8741 56.5152 41.9002 177.8182 7 T 3.8663 7.7960 115.3220 63.7967 68.9856 173.5968 8 G 3.6604 7.7204 112.1771 43.8278 0.0000 171.8242 9 K 5.0873 7.9542 118.3604 54.5287 34.9788 175.8213 10 W 5.6156 9.3644 124.9452 56.0673 33.9368 174.9076 11 T 5.3510 9.2920 116.7158 59.7797 72.5003 172.7061 12 N 5.8596 8.6475 120.1712 49.9593 40.2468 175.1436 13 N 4.4294 8.6966 115.2132 55.1702 37.3866 175.7085 14 L 4.2036 8.0101 117.7547 55.0488 42.1323 177.5540 15 G 3.9683 8.1513 107.3274 44.8668 0.0000 174.0219 16 S 4.5446 7.9549 115.6421 58.5184 64.5169 173.0341 17 I 5.0361 8.4906 123.0925 59.7600 40.2655 174.3679 18 M 5.0322 9.1065 125.5652 53.9820 36.0216 173.8008 19 T 5.0496 8.9108 121.9846 61.8317 71.7913 172.9053 20 I 4.7313 8.8185 127.4484 59.8623 39.6602 175.8280 21 R 4.5612 8.4070 127.7129 55.2768 32.7658 175.8297 22 A 4.0045 8.5945 123.6159 53.1092 18.9994 177.3871 23 V 4.3102 7.6112 123.4352 61.5328 32.4418 176.0733 24 N 4.7910 8.7945 125.9099 51.7999 38.7935 175.7897 25 S 4.2115 8.4889 111.7540 61.1185 63.1434 175.0422 26 R 4.1873 8.1690 118.1696 56.0501 30.1517 177.0766 27 G 4.2872 8.2740 106.5674 46.4472 0.0000 173.2275 28 E 4.8611 8.4342 119.7870 55.8508 31.1642 175.5888 29 F 5.2806 8.4176 116.5981 55.9990 41.8487 173.1914 30 T 4.9954 8.2213 110.1445 60.3503 72.5491 172.7696 31 G 4.5380 7.7688 106.0878 46.6724 0.0000 172.2239 32 T 5.3999 8.2115 108.6892 60.2109 73.0465 172.5775 33 Y 4.8774 9.0533 123.2209 56.1676 42.5256 173.4361 34 L 4.7076 9.1516 129.9394 53.4519 43.5412 175.3182 35 T 4.5284 8.9647 120.7943 61.8415 68.0643 174.4534 36 A 4.2700 8.5727 130.4281 53.7463 19.0270 177.9980 37 V 4.4386 7.2773 107.0569 59.8858 35.3921 174.3239 38 A 4.3465 7.8984 123.0500 51.3286 21.8276 176.3595 39 D 4.4930 8.6792 119.3094 57.1320 41.0424 177.2568 40 N 4.9445 7.6783 116.4286 50.0782 39.4048 172.7651 41 P 4.1022 0.0000 0.0000 65.0587 31.9243 179.8181 42 G 3.6386 8.0051 106.9553 47.8459 0.0000 173.7101 43 N 4.5684 7.8893 115.8097 53.4188 39.1692 175.6618 44 I 2.0000 6.8483 120.0532 61.1505 37.4735 175.4163 45 T 4.6824 7.2325 113.5388 59.0204 71.9377 173.1292 46 L 4.2358 8.6040 124.1936 56.2470 42.5618 176.3914 47 S 5.0648 9.0729 121.0039 56.0581 67.4321 171.7609 48 P 5.0833 0.0000 0.0000 62.5656 33.1116 174.8387 49 L 5.8187 8.6032 120.6672 53.1254 44.4908 174.9557 50 L 4.9177 8.2575 120.6580 53.8785 45.8389 175.0283 51 G 4.1364 8.0542 111.9203 45.3405 0.0000 171.1075 52 I 5.2826 8.3999 119.3401 59.4544 41.4965 175.1070 53 Q 5.3785 9.2750 123.9497 54.4476 32.1421 174.5996 54 H 4.6295 8.7793 117.8861 55.8595 29.4571 176.0847 55 K 4.2889 8.7033 123.1127 58.8269 32.6778 178.5213 56 R 4.1120 7.9526 115.9941 58.2210 30.5396 177.1162 57 A 4.2185 7.8217 120.2977 51.8032 18.9751 177.6445 58 S 4.3417 8.6773 116.2950 60.6979 63.6768 174.5046 59 Q 4.8432 7.8493 118.8776 51.9387 28.3468 173.4398 60 P 4.6398 0.0000 0.0000 62.6381 33.5743 176.8028 61 T 4.8656 8.4219 111.7806 61.6234 71.2332 172.9178 62 F 5.2334 8.1041 116.3018 56.5705 41.8420 172.8212 63 G 4.7775 9.3433 105.6297 45.2096 0.0000 171.6414 64 F 5.5316 9.0922 115.0189 55.8643 42.0959 172.9536 65 T 4.9766 9.0662 116.9870 61.8905 71.4258 173.4486 66 V 4.3391 8.7178 126.8762 61.4165 33.2665 174.2195 67 H 4.3814 8.3745 129.5863 54.4860 29.7628 174.5949 68 W 4.2967 7.4659 126.7678 56.7610 28.9549 176.7187 69 N 4.6753 9.4418 122.1668 54.1846 38.4247 175.6062 70 F 4.9935 7.4554 111.6530 56.0979 38.7460 174.1446 71 S 4.5128 7.1532 114.2424 57.7609 65.4142 173.5728 72 E 4.2716 8.4488 118.1046 56.8635 29.2663 177.2198 73 S 4.7862 7.6323 116.0434 58.6732 64.6815 173.2836 74 T 5.0219 8.8376 117.2493 62.2663 72.8146 173.2167 75 T 5.1639 8.4003 120.5491 61.8880 72.1465 173.4421 76 V 4.8993 8.6616 118.3216 59.5850 35.0193 174.6783 77 F 5.3053 8.8523 122.5900 55.9928 42.2778 174.2755 78 T 4.6928 8.8709 116.4784 60.7191 71.3885 173.6357 79 G 4.1577 6.8710 110.5278 46.4674 0.0000 171.4245 80 Q 4.9486 7.9726 120.1522 54.4395 32.6522 174.3189 81 C 5.2169 8.9385 125.9414 55.5820 45.1701 172.2149 82 F 5.3770 9.2866 124.9803 55.8374 41.9667 174.3741 83 I 5.1272 8.8147 122.6253 59.5707 39.4831 175.7728 84 D 4.7248 9.0650 127.1838 53.5249 41.6076 177.5799 85 R 3.9929 8.4486 116.1490 59.2502 29.3616 177.2849 86 N 4.5323 8.1754 113.4750 53.2004 38.8791 175.7169 87 G 3.9141 7.9370 106.6197 45.0700 0.0000 173.2678 88 K 4.3029 7.7945 121.6791 55.8692 33.2287 175.4055 89 E 5.2613 8.8505 126.5047 55.3329 31.9287 175.1295 90 V 4.9982 8.8654 122.3934 61.3420 35.5313 173.8813 91 L 5.0910 9.1920 127.7441 53.4465 43.6405 175.4348 92 K 5.1490 9.1976 124.4550 55.1327 34.0704 175.7492 93 T 5.3588 9.2398 114.7455 60.3171 72.8096 172.6981 94 M 5.4586 9.0836 121.3656 53.4081 36.5085 174.6055 95 W 5.4926 8.4315 116.7910 54.7951 32.4204 173.7591 96 L 5.3464 8.7987 120.5887 52.9700 44.5837 175.1675 97 L 4.9560 9.4250 126.6299 53.4316 44.3351 174.8617 98 R 4.8578 9.1005 128.5730 55.2284 31.3269 175.6496 99 S 4.8204 8.8172 123.4584 57.7221 64.3547 173.9516 100 S 4.3592 8.4771 117.8765 58.1355 62.6744 173.7535 101 V 4.4522 8.1560 119.3933 59.2072 34.7590 175.5544 102 N 4.4859 8.5423 118.9767 56.3377 38.7942 174.7882 103 D 4.6654 7.7860 115.2889 51.0386 42.2562 175.7355 104 I 3.7954 8.3618 118.5366 63.9333 37.5254 177.4472 105 S 4.2808 8.2244 114.1623 60.4978 63.0879 174.8932 106 Y 4.6727 7.8764 119.3212 57.9186 38.1305 176.6263 107 D 4.3788 8.1738 121.7939 57.0415 41.0369 177.9761 108 W 4.3682 8.4603 115.7324 58.9279 27.9224 176.5846 109 K 3.6711 6.6734 114.9829 56.1469 32.0833 176.6364 110 A 4.2471 7.6754 122.0051 52.8551 19.1801 176.9237 111 T 5.0431 7.5386 112.4352 61.8111 71.2203 173.7924 112 R 4.7894 9.0460 126.3920 54.7769 32.5828 176.0273 113 V 4.4731 7.7315 120.2218 60.3385 34.7533 175.1953 114 G 3.1362 6.1576 106.9026 45.8384 0.0000 171.3643 115 Y 5.4594 7.9601 116.6144 55.6375 41.6776 174.5115 116 N 5.3704 9.6079 116.3273 52.1355 43.9461 173.1741 117 N 5.8004 9.3415 120.3963 51.3878 40.0533 173.6174 118 F 5.6536 9.6076 121.0294 56.0408 42.5144 174.4328 119 T 5.4674 9.0444 111.4846 59.7215 72.5602 173.3274 120 R 3.6799 8.4226 121.0325 56.2248 30.2770 176.8841 121 L 4.0567 8.3344 125.9438 57.4390 42.7518 176.8174 122 S 4.1659 7.5551 116.0746 58.2612 62.6875 173.0923 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 3 K 8.31 4.30 0.00 1.73 1.79 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.52 7.81 4 C 8.19 5.00 0.00 3.26 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 5 S 8.81 4.52 0.00 3.87 3.73 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 0.00 0.00 0.00 0.00 6 L 8.09 4.15 0.00 1.03 0.93 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.80 3.87 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 1.25 0.00 0.00 8 G 7.72 3.66 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 0.00 0.00 0.00 9 K 7.95 5.09 0.00 1.54 1.62 0.00 1.54 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.34 7.81 10 W 9.36 5.62 0.00 3.18 3.19 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 11 T 9.29 5.35 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 1.21 0.00 0.00 12 N 8.65 5.86 0.00 2.20 1.42 0.00 0.00 6.64 6.84 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 13 N 8.70 4.43 0.00 2.91 3.22 0.00 0.00 5.95 7.79 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 14 L 8.01 4.20 0.00 1.81 1.75 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.15 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.95 4.54 0.00 3.94 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 17 I 8.49 5.04 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.84 0.89 0.00 0.00 18 M 9.11 5.03 0.00 1.94 1.42 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 19 T 8.91 5.05 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 1.18 0.00 0.00 20 I 8.82 4.73 1.90 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.52 0.37 0.00 0.00 21 R 8.41 4.56 0.00 1.71 1.90 0.00 3.17 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 22 A 8.59 4.00 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 23 V 7.61 4.31 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 0.95 0.00 0.00 0.86 0.00 0.00 24 N 8.79 4.79 0.00 3.00 2.99 0.00 0.00 6.30 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 25 S 8.49 4.21 0.00 4.01 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 26 R 8.17 4.19 0.00 1.96 2.00 0.00 3.24 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 27 G 8.27 4.29 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 0.00 28 E 8.43 4.86 0.00 2.01 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 2.24 2.23 0.00 29 F 8.42 5.28 0.00 3.01 3.04 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 30 T 8.22 5.00 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 1.19 0.00 0.00 31 G 7.77 4.54 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 0.00 0.00 0.00 32 T 8.21 5.40 4.29 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 1.23 0.00 0.00 33 Y 9.05 4.88 0.00 2.96 2.76 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 34 L 9.15 4.71 0.00 1.79 1.55 0.97 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.96 4.53 4.68 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 1.23 0.00 0.00 36 A 8.57 4.27 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 37 V 7.28 4.44 2.03 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 0.70 0.00 0.00 0.87 0.00 0.00 38 A 7.90 4.35 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 39 D 8.68 4.49 0.00 2.62 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 40 N 7.68 4.94 0.00 2.72 2.69 0.00 0.00 6.89 8.03 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 41 P 0.00 4.10 0.00 2.15 2.24 0.00 3.66 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 42 G 8.01 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 43 N 7.89 4.57 0.00 2.89 2.96 0.00 0.00 6.99 8.31 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 44 I 6.85 2.00 1.64 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 0.78 0.01 0.73 0.00 0.00 45 T 7.23 4.68 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 1.27 0.00 0.00 46 L 8.60 4.24 0.00 1.72 1.71 1.01 0.88 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 47 S 9.07 5.06 0.00 3.97 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 48 P 0.00 5.08 0.00 2.08 2.16 0.00 3.91 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 49 L 8.60 5.82 0.00 1.95 1.73 0.83 -0.16 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 50 L 8.26 4.92 0.00 1.66 1.41 0.88 0.79 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 51 G 8.05 4.14 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 0.00 0.00 0.00 52 I 8.40 5.28 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.91 0.89 0.00 0.00 53 Q 9.28 5.38 0.00 2.23 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.01 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 54 H 8.78 4.63 0.00 3.21 3.32 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.70 4.29 0.00 1.78 1.89 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.50 7.81 56 R 7.95 4.11 0.00 1.83 2.00 0.00 3.23 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 57 A 7.82 4.22 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 58 S 8.68 4.34 0.00 4.02 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 59 Q 7.85 4.84 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 60 P 0.00 4.64 0.00 2.23 2.35 0.00 3.68 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 61 T 8.42 4.87 4.15 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 1.13 0.00 0.00 62 F 8.10 5.23 0.00 3.50 3.26 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 63 G 9.34 4.78 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 0.00 0.00 0.00 64 F 9.09 5.53 0.00 3.21 3.20 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 65 T 9.07 4.98 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 1.16 0.00 0.00 66 V 8.72 4.34 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 -0.55 0.00 0.00 0.75 0.00 0.00 67 H 8.37 4.38 0.00 3.09 3.11 0.00 6.00 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 W 7.47 4.30 0.00 2.66 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 0.00 0.00 0.00 0.00 69 N 9.44 4.68 0.00 2.95 3.02 0.00 0.00 6.83 8.06 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 70 F 7.46 4.99 0.00 3.16 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 71 S 7.15 4.51 0.00 3.82 3.59 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 72 E 8.45 4.27 0.00 1.94 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 2.26 2.24 0.00 73 S 7.63 4.79 0.00 3.69 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 74 T 8.84 5.02 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 1.18 0.00 0.00 75 T 8.40 5.16 4.38 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 0.72 0.00 0.00 76 V 8.66 4.90 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 0.75 0.00 0.00 0.90 0.00 0.00 77 F 8.85 5.31 0.00 1.51 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 78 T 8.87 4.69 4.16 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 1.14 0.00 0.00 79 G 6.87 4.16 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 0.00 80 Q 7.97 4.95 0.00 1.88 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.80 0.00 0.00 0.00 0.00 0.00 1.25 2.05 0.00 81 C 8.94 5.22 0.00 3.03 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 82 F 9.29 5.38 0.00 3.06 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 83 I 8.81 5.13 1.96 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 1.31 0.69 0.97 0.00 0.00 84 D 9.06 4.72 0.00 2.99 2.74 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 85 R 8.45 3.99 0.00 1.93 2.09 0.00 3.03 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 86 N 8.18 4.53 0.00 2.76 2.91 0.00 0.00 7.03 7.65 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 87 G 7.94 3.91 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 0.00 0.00 0.00 88 K 7.79 4.30 0.00 1.89 1.91 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.51 7.81 89 E 8.85 5.26 0.00 2.15 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 0.00 2.48 2.39 0.00 90 V 8.87 5.00 2.33 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 1.31 0.00 0.00 1.08 0.00 0.00 91 L 9.19 5.09 0.00 1.75 1.70 -0.61 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 92 K 9.20 5.15 0.00 2.01 1.94 0.00 1.81 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.74 1.77 7.81 93 T 9.24 5.36 4.71 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 1.66 0.00 0.00 94 M 9.08 5.46 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 95 W 8.43 5.49 0.00 2.71 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 0.00 0.00 0.00 0.00 96 L 8.80 5.35 0.00 1.60 1.60 0.91 0.40 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 97 L 9.43 4.96 0.00 1.61 1.75 0.86 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 98 R 9.10 4.86 0.00 1.93 1.92 0.00 3.33 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 99 S 8.82 4.82 0.00 3.69 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 0.00 100 S 8.48 4.36 0.00 3.85 3.72 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 0.00 101 V 8.16 4.45 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 0.73 0.00 0.00 1.03 0.00 0.00 102 N 8.54 4.49 0.00 2.70 2.94 0.00 0.00 6.74 8.06 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 0.00 103 D 7.79 4.67 0.00 2.92 2.82 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 0.00 104 I 8.36 3.80 1.90 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 1.72 1.35 0.93 0.00 0.00 105 S 8.22 4.28 0.00 3.94 3.91 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 0.00 106 Y 7.88 4.67 0.00 3.14 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 0.00 107 D 8.17 4.38 0.00 2.93 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 0.00 108 W 8.46 4.37 0.00 3.62 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 0.00 109 K 6.67 3.67 0.00 0.98 0.74 0.00 1.12 0.00 0.00 1.52 0.00 0.00 2.56 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.99 0.92 7.81 110 A 7.68 4.25 1.32 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 0.00 0.00 0.00 111 T 7.54 5.04 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 1.23 0.00 0.00 112 R 9.05 4.79 0.00 1.94 2.06 0.00 3.14 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 113 V 7.73 4.47 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 0.58 0.00 0.00 0.75 0.00 0.00 114 G 6.16 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 0.00 0.00 0.00 115 Y 7.96 5.46 0.00 3.08 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 0.00 116 N 9.61 5.37 0.00 3.17 2.54 0.00 0.00 6.98 6.46 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 0.00 117 N 9.34 5.80 0.00 2.96 3.13 0.00 0.00 6.67 8.20 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 0.00 118 F 9.61 5.65 0.00 2.81 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 0.00 119 T 9.04 5.47 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 1.38 0.00 0.00 120 R 8.42 3.68 0.00 1.41 1.50 0.00 2.88 0.00 0.00 2.69 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 121 L 8.33 4.06 0.00 1.54 1.56 0.90 1.11 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 0.00 122 S 7.56 4.17 0.00 3.72 3.55 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