NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3735 8.3344 116.7948 58.7508 64.7482 173.4500 2 M 4.1435 8.1870 122.3196 53.9340 30.6028 174.1708 3 Q 3.9377 7.8039 121.4220 58.4767 30.7203 176.3972 4 D 4.8033 7.8127 117.4862 52.1167 41.5182 174.1221 5 P 4.7017 0.0000 0.0000 62.9527 31.7958 176.3483 6 I 4.2772 7.6811 118.8826 61.4793 37.5720 176.1860 7 A 4.4695 7.9257 124.6928 53.7680 20.5207 179.2561 8 D 4.5237 8.1895 115.1333 57.8636 41.1323 177.6939 9 M 4.4349 7.3359 112.1726 55.7435 32.4050 176.5106 10 L 4.6758 9.0944 117.8143 54.6327 43.3962 176.8212 11 T 4.3255 7.5538 107.1635 63.4575 70.5613 176.1225 12 R 3.9652 7.6045 121.3375 59.4711 30.0351 177.8760 13 I 3.5687 8.0625 117.7068 65.0971 36.6442 177.5500 14 R 3.7356 7.7574 120.7447 60.2513 30.1334 178.0030 15 N 4.4723 9.2030 115.7441 56.5429 38.8633 177.4509 16 G 3.7853 8.4544 107.0264 48.2796 0.0000 175.5874 17 Q 4.4253 8.0700 119.4837 57.4788 28.7022 177.6720 18 A 4.6773 7.5525 119.3249 51.8705 19.5642 175.9448 19 A 4.5854 8.4771 119.1292 51.8482 19.0431 177.1694 20 N 4.2245 8.2873 112.7370 55.1135 36.4355 174.7994 21 K 4.2655 8.1639 115.2848 55.4459 32.0921 176.1491 22 A 3.7943 8.4928 119.7714 56.1261 19.1544 179.0621 23 A 4.9181 8.2092 121.0040 49.2625 22.5281 179.4384 24 V 4.6198 8.0012 124.8660 65.4689 35.3348 169.1662 25 T 5.2524 8.5684 121.9169 61.5446 68.3942 173.4439 26 M 4.8388 8.4815 122.4052 53.2177 33.8131 172.2744 27 P 4.6155 0.0000 0.0000 63.3525 32.0175 174.5478 28 S 4.9275 8.3778 113.2465 56.9396 66.5092 172.7222 29 S 4.5896 8.1477 113.6780 56.9710 65.7779 173.5347 30 K 4.0253 8.4358 120.0390 58.4115 31.6252 176.7009 31 L 4.1056 7.5991 121.6738 55.7232 42.9550 179.6896 32 K 4.5196 8.8995 117.3782 57.6437 32.6105 178.4218 33 V 2.7891 8.2499 109.0723 65.4383 31.6867 177.5513 34 A 3.9153 5.8000 117.2497 56.1396 19.3853 179.2107 35 I 3.4690 8.1625 116.9414 63.9555 36.9169 178.1279 36 A 3.9236 8.5408 121.5301 55.6874 18.5226 179.3841 37 N 4.5169 7.9523 114.8237 55.8264 38.6350 175.9788 38 V 4.3557 8.0864 119.8631 61.9795 33.0219 177.0725 39 L 4.6611 7.9243 121.3148 57.1876 43.3554 177.5992 40 K 4.0621 8.1781 117.1886 60.5551 32.0870 177.3145 41 E 4.2255 8.2562 119.9264 57.9354 29.8477 177.7126 42 E 4.0875 7.5936 116.3068 55.9673 31.0846 175.9544 43 G 3.6062 8.3385 106.2490 46.1300 0.0000 173.2727 44 F 5.0791 7.4881 113.4836 56.6962 42.1293 176.0444 45 I 4.7603 7.5922 112.7681 58.6453 39.8993 175.3727 46 E 4.1160 8.8548 124.0400 57.6142 30.5274 177.5850 47 D 4.5072 8.0266 117.5188 55.0257 46.8205 174.1444 48 F 5.9568 7.4628 112.1875 57.5301 40.8329 173.1826 49 K 4.9068 8.6362 118.9383 55.3731 35.9739 175.1492 50 V 4.9616 8.2957 122.9612 60.4914 31.3909 175.1781 51 E 4.5308 8.2928 132.0953 56.7402 31.3599 173.1283 52 G 4.1275 8.7514 115.4815 45.5625 0.0000 173.4995 53 D 4.4751 8.7369 121.1961 56.2222 39.5208 177.6899 54 T 4.5309 7.6345 107.8106 61.6952 71.5778 173.3727 55 K 4.5184 7.5744 120.9461 55.4507 31.4378 175.2488 56 P 4.7054 0.0000 0.0000 61.8864 32.2953 178.2873 57 E 4.1498 8.5387 124.4770 57.8180 30.3695 175.8307 58 L 4.4731 7.9252 117.7591 55.1600 44.8897 174.7076 59 E 4.2972 8.7868 128.2769 56.6265 30.3966 176.1859 60 L 4.8579 8.6248 128.3854 53.3371 43.7530 174.7390 61 T 4.4285 8.5613 116.6255 60.3286 69.4209 175.3989 62 L 4.3969 7.8637 132.0415 55.3575 41.8341 176.7696 63 K 4.3168 7.0787 121.3004 57.5636 34.7137 173.8838 64 Y 4.8823 8.5534 124.3414 55.1768 37.9421 174.9238 65 F 4.1030 8.3062 123.3492 61.0174 40.9409 178.0280 66 Q 4.4002 7.7184 124.2421 55.4622 28.1064 178.0907 67 G 3.6709 8.8786 111.7750 48.8049 0.0000 173.3562 68 K 4.5405 7.7372 117.2102 54.2309 34.2492 176.5099 69 A 4.4598 8.3182 123.1282 52.4214 19.5854 177.9542 70 V 4.3291 7.6238 110.6243 61.4772 31.8748 176.6972 71 V 4.3250 7.3846 113.1067 59.5983 34.8419 175.0232 72 E 4.4831 8.3417 120.5019 55.5535 30.6566 175.5601 73 S 4.5809 7.2598 111.6708 58.0790 65.4436 175.0033 74 I 4.3081 8.0788 125.6151 60.1266 40.7297 172.9080 75 Q 4.4249 8.0252 126.2980 55.2695 33.0791 173.5015 76 R 4.2502 8.2700 123.8923 56.4333 31.6002 174.6904 77 V 4.1374 8.0823 116.5443 62.2103 38.1052 173.2238 78 S 4.1195 8.3103 119.4796 58.5910 61.7916 173.4460 79 R 4.6651 8.1929 123.1361 53.2463 32.1867 173.5828 80 P 4.4483 0.0000 0.0000 63.6761 31.8131 176.8699 81 G 3.9075 8.6171 106.0349 45.3267 0.0000 174.2287 82 L 5.4142 6.6762 130.8392 55.5694 44.2356 173.1403 83 R 4.5846 7.8804 123.2988 55.4224 31.4571 175.7314 84 I 4.4068 8.1495 120.2004 61.3379 40.5369 174.1458 85 Y 4.7606 8.9881 125.8117 56.2306 39.5963 175.4549 86 K 4.5363 8.4270 124.1347 54.3756 32.9552 177.2973 87 R 4.1741 8.3744 121.9109 55.7144 30.9299 176.8898 88 K 4.5124 8.3526 117.5452 57.2322 32.5912 176.5060 89 D 4.6446 7.4540 116.7537 56.7452 41.9585 177.0692 90 E 4.1912 7.9549 122.4812 56.4971 27.7318 175.2060 91 L 4.8289 7.6591 122.2286 51.8283 46.0724 174.7983 92 P 4.4108 0.0000 0.0000 62.2256 31.5279 175.2649 93 K 3.8392 7.6221 121.9719 53.6512 32.7596 176.8438 94 V 3.4853 8.4072 122.1142 63.8662 32.5209 170.4130 95 M 2.9566 9.5157 129.1427 56.8850 30.1323 177.7513 96 A 3.7556 8.6198 117.1915 52.5776 18.2108 177.1877 97 G 3.5740 7.7563 106.2892 45.7229 0.0000 175.3898 98 L 4.5554 7.6674 119.7605 54.9148 41.2451 176.4370 99 G 4.4758 7.8129 107.0835 44.0034 0.0000 172.7191 100 I 4.8115 7.6348 112.5584 61.1030 38.6743 174.7994 101 A 4.6288 8.0674 118.6137 51.6870 21.8463 176.9929 102 V 3.9187 8.1729 117.7851 61.4587 32.8985 175.5582 103 V 4.4333 8.3277 126.6745 60.6163 32.6778 176.1602 104 S 5.1060 8.6276 126.9220 57.0846 59.8376 174.4404 105 T 4.7751 7.4020 111.0849 61.6978 68.8648 174.7341 106 S 4.2845 8.6195 114.9935 61.5709 62.8331 175.1623 107 K 4.3136 7.8116 120.2848 57.5108 34.1201 178.4503 108 G 4.2886 8.1272 105.6511 45.9185 0.0000 174.2328 109 V 5.4914 8.4072 115.2449 61.9995 33.4208 173.7380 110 M 4.4266 7.8252 124.1974 54.4941 34.1815 174.0645 111 T 5.2233 8.0332 109.9108 60.1527 71.2014 172.8685 112 D 4.3190 8.3540 119.6351 57.8690 38.8577 178.4525 113 R 3.9363 7.8602 119.9366 57.9196 30.1366 178.6124 114 A 3.8951 7.4761 118.6730 54.9778 18.8776 178.7027 115 A 4.1104 8.3106 119.4333 55.8713 18.4594 180.2483 116 R 3.9946 7.7775 115.4299 59.1229 29.8853 178.7528 117 Q 3.9925 8.0966 119.0771 58.5207 28.9505 177.2858 118 A 4.4555 7.5647 117.3471 50.5917 20.5008 173.9308 119 G 3.7134 8.9014 106.3940 45.5768 0.0000 172.7432 120 L 4.8566 7.8822 124.4136 53.0054 46.1926 177.4068 121 G 3.9304 8.6162 107.0653 45.1867 0.0000 176.4241 122 G 3.6910 7.9831 105.0862 44.8718 0.0000 176.1319 123 E 4.2567 8.2925 127.2958 54.7636 31.3825 171.4799 124 I 3.8171 7.8846 127.5293 61.5086 36.9423 175.3795 125 I 3.9335 9.1155 130.4127 62.5532 37.3284 174.9210 126 C 5.2344 7.9130 113.7204 55.4825 33.0936 173.0642 127 Y 4.6778 8.7516 121.8167 57.3486 39.6231 175.5412 128 V 4.0476 8.1581 112.6673 60.5878 35.7494 174.0872 129 A 4.2869 8.2849 128.5358 52.2772 18.7241 176.6105 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 S 8.33 4.37 0.00 3.88 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 2 M 8.19 4.14 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.62 0.00 3 Q 7.80 3.94 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 4 D 7.81 4.80 0.00 2.61 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 5 P 0.00 4.70 0.00 2.24 2.24 0.00 3.70 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 6 I 7.68 4.28 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.49 0.88 0.00 0.00 7 A 7.93 4.47 1.26 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 0.00 0.00 8 D 8.19 4.52 0.00 2.67 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 9 M 7.34 4.43 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 10 L 9.09 4.68 0.00 1.57 1.56 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.55 4.33 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 1.25 0.00 0.00 12 R 7.60 3.97 0.00 1.98 2.05 0.00 3.24 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 13 I 8.06 3.57 1.89 0.00 0.00 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 1.50 0.60 0.84 0.00 0.00 14 R 7.76 3.74 0.00 2.01 1.93 0.00 3.25 0.00 0.00 3.16 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 15 N 9.20 4.47 0.00 2.82 2.89 0.00 0.00 7.05 7.88 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 16 G 8.45 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 0.00 0.00 0.00 17 Q 8.07 4.43 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 18 A 7.55 4.68 1.26 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 0.00 0.00 19 A 8.48 4.59 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.29 4.22 0.00 2.76 2.69 0.00 0.00 7.13 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 21 K 8.16 4.27 0.00 1.98 1.80 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.41 7.81 22 A 8.49 3.79 1.28 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 0.00 0.00 23 A 8.21 4.92 1.03 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 0.00 0.00 24 V 8.00 4.62 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 0.82 0.00 0.00 0.95 0.00 0.00 25 T 8.57 5.25 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 26 M 8.48 4.84 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 27 P 0.00 4.62 0.00 2.08 2.15 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 28 S 8.38 4.93 0.00 3.80 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 29 S 8.15 4.59 0.00 3.91 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 30 K 8.44 4.03 0.00 1.72 1.85 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.40 7.81 31 L 7.60 4.11 0.00 1.74 1.46 0.89 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.90 4.52 0.00 1.79 1.70 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 33 V 8.25 2.79 2.34 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 0.97 0.00 0.00 0.88 0.00 0.00 34 A 5.80 3.92 1.26 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 0.00 0.00 35 I 8.16 3.47 1.95 0.00 0.00 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 1.54 0.88 0.89 0.00 0.00 36 A 8.54 3.92 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 37 N 7.95 4.52 0.00 2.81 2.91 0.00 0.00 6.96 7.46 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 38 V 8.09 4.36 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 1.02 0.00 0.00 1.00 0.00 0.00 39 L 7.92 4.66 0.00 1.74 1.91 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.18 4.06 0.00 2.04 2.06 0.00 2.01 0.00 0.00 2.12 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.80 7.81 41 E 8.26 4.23 0.00 1.95 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 0.00 2.37 2.56 0.00 42 E 7.59 4.09 0.00 1.83 1.73 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 2.28 2.39 0.00 43 G 8.34 3.61 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 0.00 0.00 0.00 44 F 7.49 5.08 0.00 3.01 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 45 I 7.59 4.76 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 0.96 0.00 0.00 46 E 8.85 4.12 0.00 2.02 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 2.53 0.00 47 D 8.03 4.51 0.00 2.65 2.25 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 48 F 7.46 5.96 0.00 3.08 3.02 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 49 K 8.64 4.91 0.00 1.85 1.69 0.00 1.68 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.46 7.81 50 V 8.30 4.96 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 0.93 0.00 0.00 0.95 0.00 0.00 51 E 8.29 4.53 0.00 2.07 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 0.00 2.35 2.32 0.00 52 G 8.75 4.13 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 0.00 53 D 8.74 4.48 0.00 2.80 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 54 T 7.63 4.53 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 55 K 7.57 4.52 0.00 1.74 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.52 7.81 56 P 0.00 4.71 0.00 2.03 2.20 0.00 3.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 57 E 8.54 4.15 0.00 1.97 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 0.00 2.32 2.30 0.00 58 L 7.93 4.47 0.00 1.88 1.48 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.79 4.30 0.00 2.14 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 0.00 2.36 2.44 0.00 60 L 8.62 4.86 0.00 1.88 1.56 0.95 0.79 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 61 T 8.56 4.43 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 1.27 0.00 0.00 62 L 7.86 4.40 0.00 1.88 1.18 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.08 4.32 0.00 1.75 1.72 0.00 1.70 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.30 7.81 64 Y 8.55 4.88 0.00 2.88 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 65 F 8.31 4.10 0.00 2.96 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 66 Q 7.72 4.40 0.00 2.21 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 1.80 2.57 0.00 67 G 8.88 3.67 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 0.00 0.00 0.00 68 K 7.74 4.54 0.00 1.82 1.81 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.52 7.81 69 A 8.32 4.46 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 70 V 7.62 4.33 2.28 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 0.84 0.00 0.00 1.06 0.00 0.00 71 V 7.38 4.32 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 0.47 0.00 0.00 0.82 0.00 0.00 72 E 8.34 4.48 0.00 2.06 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 2.18 2.22 0.00 73 S 7.26 4.58 0.00 3.87 3.68 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 74 I 8.08 4.31 1.53 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.54 0.72 0.00 0.00 75 Q 8.03 4.42 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.50 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 76 R 8.27 4.25 0.00 1.81 1.83 0.00 3.35 0.00 0.00 3.40 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 77 V 8.08 4.14 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 0.70 0.00 0.00 1.08 0.00 0.00 78 S 8.31 4.12 0.00 3.85 3.90 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 79 R 8.19 4.67 0.00 2.10 1.95 0.00 2.85 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.55 0.00 80 P 0.00 4.45 0.00 2.07 2.06 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 81 G 8.62 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 82 L 6.68 5.41 0.00 1.68 1.61 0.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 83 R 7.88 4.58 0.00 2.01 2.08 0.00 3.35 0.00 0.00 3.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.74 0.00 84 I 8.15 4.41 1.86 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 1.38 0.76 0.92 0.00 0.00 85 Y 8.99 4.76 0.00 2.69 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 86 K 8.43 4.54 0.00 1.78 1.94 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.39 7.81 87 R 8.37 4.17 0.00 1.89 1.90 0.00 3.13 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 88 K 8.35 4.51 0.00 1.85 1.82 0.00 1.59 0.00 0.00 2.37 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.28 7.81 89 D 7.45 4.64 0.00 2.82 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 90 E 7.95 4.19 0.00 1.93 1.92 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 2.30 2.34 0.00 91 L 7.66 4.83 0.00 1.61 1.49 1.02 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.41 0.00 2.02 1.93 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 93 K 7.62 3.84 0.00 1.67 1.62 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.54 7.81 94 V 8.41 3.49 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 0.99 0.00 0.00 0.96 0.00 0.00 95 M 9.52 2.96 0.00 2.24 2.04 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 2.62 2.53 0.00 96 A 8.62 3.76 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 97 G 7.76 3.57 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 0.00 0.00 0.00 98 L 7.67 4.56 0.00 1.72 1.72 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.81 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.63 4.81 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.92 0.98 0.00 0.00 101 A 8.07 4.63 1.29 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 0.00 102 V 8.17 3.92 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 0.98 0.00 0.00 103 V 8.33 4.43 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 0.98 0.00 0.00 0.95 0.00 0.00 104 S 8.63 5.11 0.00 3.91 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 0.00 105 T 7.40 4.78 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 1.27 0.00 0.00 106 S 8.62 4.28 0.00 3.89 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 0.00 107 K 7.81 4.31 0.00 1.71 1.77 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.43 7.81 108 G 8.13 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 0.00 109 V 8.41 5.49 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 0.94 0.00 0.00 0.91 0.00 0.00 110 M 7.83 4.43 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 111 T 8.03 5.22 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 0.00 112 D 8.35 4.32 0.00 2.98 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 0.00 113 R 7.86 3.94 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 114 A 7.48 3.90 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 0.00 115 A 8.31 4.11 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 0.00 116 R 7.78 3.99 0.00 1.89 1.99 0.00 3.17 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.63 0.00 117 Q 8.10 3.99 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 118 A 7.56 4.46 1.26 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 0.00 0.00 119 G 8.90 3.71 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 0.00 0.00 0.00 120 L 7.88 4.86 0.00 1.73 1.51 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.62 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 0.00 0.00 0.00 122 G 7.98 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 0.00 0.00 0.00 123 E 8.29 4.26 0.00 1.65 1.59 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 1.88 1.47 0.00 124 I 7.88 3.82 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.80 0.89 0.00 0.00 125 I 9.12 3.93 1.93 0.00 0.00 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 1.28 0.59 0.88 0.00 0.00 126 C 7.91 5.23 0.00 2.88 2.97 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 0.00 127 Y 8.75 4.68 0.00 2.97 3.10 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 0.00 0.00 0.00 0.00 128 V 8.16 4.05 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 0.66 0.00 0.00 0.93 0.00 0.00 129 A 8.28 4.29 1.41 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 0.00 0.00