NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7862 8.0544 120.3882 65.0118 32.8619 176.2970 2 H 3.8296 8.1200 124.5020 56.9579 27.3825 171.1928 3 L 4.6860 8.1072 121.1770 52.6228 45.8662 177.2000 4 T 4.2717 8.0663 119.2970 62.1998 70.7638 174.4110 5 P 4.4710 0.0000 0.0000 65.8156 31.7521 178.7099 6 E 3.9111 8.2800 115.9291 59.7874 28.9310 179.1267 7 E 4.0176 7.8777 118.4688 59.1011 29.2285 178.9084 8 K 4.0532 8.8669 119.1615 58.3904 32.1250 178.7888 9 S 4.6378 8.1217 114.1537 59.8742 63.2444 176.0501 10 A 3.9384 7.4304 123.4824 54.9315 18.0754 179.2215 11 V 3.5509 7.3657 116.9822 66.2242 31.2539 177.8845 12 T 3.9309 7.2036 113.5627 67.8187 68.6233 175.6117 13 A 3.9695 8.5575 121.0075 55.2097 18.3067 179.6622 14 L 3.7352 8.0437 115.7195 57.6350 42.6659 179.5349 15 W 4.2666 8.8189 128.8412 60.6175 30.3954 177.9171 16 G 3.7579 8.8423 104.4028 46.6146 0.0000 174.0897 17 K 4.3945 7.9544 119.0167 56.1331 32.9478 177.0122 18 V 3.4593 7.3885 120.5241 62.7171 31.7723 176.1112 19 N 4.4954 8.1915 125.6287 51.8510 38.2687 175.1765 20 V 3.4449 7.9954 126.6236 66.0296 31.8083 176.7748 21 D 4.3736 8.1577 117.6739 57.6317 40.7134 178.8963 22 E 3.9977 8.3778 118.5783 59.3791 29.6841 179.6151 23 V 3.5518 8.0301 118.7731 65.9905 31.5165 178.3847 24 G 3.7390 8.1540 105.6051 47.5900 0.0000 175.9267 25 G 3.6052 7.7078 106.8756 47.5144 0.0000 175.6017 26 E 3.9702 8.1124 120.8938 58.6803 29.4503 178.6711 27 A 3.9312 7.8731 120.9294 55.0700 18.5111 179.1904 28 L 3.9870 8.0287 118.1150 58.1485 41.9450 179.5174 29 G 3.5341 7.9825 105.6156 47.8782 0.0000 175.7058 30 R 4.0226 8.2815 120.1171 57.1262 29.9383 178.4906 31 L 4.1823 7.5822 121.2559 57.6968 42.5741 178.3497 32 L 4.3799 7.5606 119.9091 57.2028 41.2903 179.8162 33 V 3.6242 7.7707 117.5114 66.0013 31.6856 178.1004 34 V 3.5239 7.8357 116.6013 64.2098 32.7836 175.5556 35 Y 3.9718 7.3618 115.6446 54.0271 38.0051 173.9981 36 P 4.3317 0.0000 0.0000 64.7268 31.8677 177.9383 37 W 4.4298 7.8668 115.1688 59.5859 28.1416 178.1596 38 T 4.2039 7.7881 111.1444 65.0341 68.1232 176.0892 39 Q 4.3107 8.3853 120.8900 58.7224 28.4901 179.0694 40 R 3.9975 8.1161 115.9953 58.3644 29.5182 177.9445 41 F 4.3303 8.0803 117.1492 57.9668 39.5271 176.7263 42 F 4.6777 7.4486 117.2236 57.0736 40.1459 177.6354 43 E 4.0898 8.2246 121.4696 59.4044 29.4923 178.9617 44 S 4.6027 8.0478 110.9097 59.5414 63.3987 175.0000 45 F 4.5337 8.5462 120.9218 59.0521 39.5692 174.8898 46 G 3.9779 7.5325 103.8551 43.7419 0.0000 172.7655 47 D 4.4893 8.6948 122.0852 54.7708 41.5174 177.0081 48 L 4.9006 8.2927 126.8297 54.5291 43.5675 178.0302 49 S 4.2627 8.2886 114.2738 61.1157 63.2404 174.3862 50 T 4.6811 7.4624 110.5931 58.1708 71.4265 173.0031 51 P 4.2214 0.0000 0.0000 66.1478 29.8251 178.7337 52 D 4.3468 7.8198 115.8857 56.4154 40.4601 177.7989 53 A 4.1185 7.6990 119.7442 52.9285 18.8700 179.1444 54 V 3.7728 7.7591 117.5873 66.0216 31.6880 177.9362 55 M 4.1777 8.0894 115.5942 57.0904 32.0183 177.0651 56 G 3.8811 7.1860 104.4139 45.2326 0.0000 173.8448 57 N 4.3888 7.7837 119.2014 52.8752 39.7453 173.6021 58 P 4.2623 0.0000 0.0000 65.3318 31.3613 178.8535 59 K 3.5922 8.8745 118.0951 58.9952 31.9052 179.2368 60 V 3.7400 7.7990 117.9840 66.0642 31.4125 177.9728 61 K 3.8844 7.9267 117.6187 59.4861 31.9107 179.0210 62 A 3.9828 7.8352 120.9121 55.6752 18.2951 179.2061 63 H 4.4190 8.4948 116.8067 59.2577 29.8524 177.7657 64 G 3.7972 8.2914 109.1391 46.9875 0.0000 175.4199 65 K 3.8885 8.1053 122.2411 59.3167 32.0651 178.6337 66 K 4.0066 7.9104 119.3645 59.4473 32.0391 178.8776 67 V 3.6983 7.8365 118.4389 65.9611 31.5933 177.4353 68 L 4.2809 8.3463 120.5667 58.5552 41.9564 178.9779 69 G 3.9579 8.7048 105.5388 48.2135 0.0000 175.2365 70 A 4.1687 8.0320 122.5377 54.3293 18.0004 179.4796 71 F 4.0015 8.4276 119.7612 61.2861 39.2136 177.3498 72 S 4.0270 8.6511 112.6871 61.5212 62.4052 175.6777 73 D 4.5827 8.1574 121.4897 57.0712 40.5459 178.8889 74 G 3.6859 7.8292 106.4315 47.1868 0.0000 175.0385 75 L 4.1322 7.3829 117.4441 55.5964 41.6796 177.7956 76 A 4.4345 7.5236 121.0502 53.2516 20.4179 178.0728 77 H 4.8384 7.6121 113.8172 55.1297 29.9658 177.2861 78 L 3.9890 8.0998 122.7371 58.1982 41.6749 178.3988 79 D 4.6220 7.9531 114.9162 54.9971 41.3364 176.5820 80 N 4.9860 8.4164 117.4821 51.9562 40.7897 174.7189 81 L 3.9690 7.9495 123.1759 57.5852 42.4305 178.7179 82 K 3.9295 8.2287 117.9622 60.1016 31.7770 179.0593 83 G 3.6953 7.8016 103.4785 48.0294 0.0000 175.4414 84 T 3.7752 7.1456 116.8855 66.4135 68.6982 175.8766 85 F 4.4898 7.9883 116.7687 57.4705 39.1067 177.2339 86 A 4.0700 7.6049 122.0838 55.6848 18.2231 180.3847 87 T 3.8370 7.8225 107.4248 65.1585 68.8773 176.5614 88 L 4.1330 7.9309 121.5193 57.1493 41.7347 178.9771 89 S 4.1817 8.5024 113.7672 61.2527 62.3474 175.6474 90 E 3.8688 8.1354 120.8075 59.6248 29.4701 179.3785 91 L 3.9461 7.7721 119.6494 58.7515 42.1911 178.7130 92 H 4.3622 8.6638 115.2998 57.6012 28.3515 176.4581 93 C 4.0717 7.4691 119.3674 61.0718 32.0728 175.3709 94 D 4.1766 8.0256 119.1815 57.1484 40.5624 177.9090 95 K 4.1048 7.7157 116.4538 58.6298 32.6837 178.0899 96 L 4.2400 7.5770 116.0223 54.8990 42.0821 176.5222 97 H 4.2810 7.3763 114.0246 56.6592 26.6972 174.6656 98 V 4.0785 7.8387 118.7009 61.4773 32.3824 174.8618 99 D 4.2614 8.6773 126.7056 53.7967 41.1120 174.8787 100 P 2.9700 0.0000 0.0000 63.7545 31.7134 177.9617 101 E 3.9222 8.3820 119.9648 59.0473 29.2895 178.1936 102 N 4.3068 8.3566 117.1276 55.9890 38.4909 177.0464 103 F 4.5179 7.1407 118.0072 60.9611 39.0507 177.5820 104 R 3.9952 7.5768 116.7147 59.5236 29.8998 178.9103 105 L 3.8872 7.8599 117.8463 57.7051 41.6322 179.1872 106 L 4.1089 7.8021 120.3836 58.0846 42.0894 179.1839 107 G 3.7564 8.2546 105.5793 48.0091 0.0000 175.2431 108 N 4.4135 8.6481 119.8574 56.1344 38.5363 177.6316 109 V 3.6619 8.5181 119.7830 65.8507 31.5435 177.7523 110 L 3.8637 8.4147 120.5637 58.2109 41.8729 179.2242 111 V 3.5724 7.8663 118.0608 65.9531 31.3776 177.9375 112 C 4.0741 8.1366 116.7413 62.7591 27.9706 176.1057 113 V 3.5378 7.9482 120.0838 65.8635 30.9540 178.1480 114 L 3.9196 7.8131 118.4847 57.7314 41.5440 179.3366 115 A 3.5857 7.0680 119.8244 54.6748 17.9372 178.9504 116 H 4.2078 7.7860 116.3244 59.0449 29.9427 176.9870 117 H 4.1343 7.7574 117.3234 58.6473 28.7952 177.0762 118 F 4.5296 8.7100 117.3394 57.0714 40.0138 178.4098 119 G 3.7345 8.4494 108.0311 46.4635 0.0000 175.9885 120 K 4.0617 9.0174 120.8917 59.5072 32.0131 177.1952 121 E 4.0378 8.3769 117.5048 59.0118 30.1408 177.1542 122 F 4.4382 8.1205 122.9039 56.6098 38.0178 174.7697 123 T 4.0649 7.3404 115.2586 61.0068 70.9826 173.2434 124 P 4.1580 0.0000 0.0000 65.5036 31.2383 177.3586 125 P 4.2619 0.0000 0.0000 65.2563 31.2652 178.9172 126 V 3.6113 7.8618 117.8387 65.7878 31.3982 177.8158 127 Q 3.5270 7.9344 119.5764 58.9521 28.5780 178.2192 128 A 4.0289 7.5286 120.3877 54.7151 18.6656 179.2862 129 A 4.0074 7.6053 118.0601 55.7149 18.2912 179.5880 130 Y 3.8978 7.8692 114.5443 61.0102 37.9752 178.8592 131 Q 4.2215 8.2709 119.4029 58.8919 28.7272 179.0175 132 K 3.9768 8.0674 119.4477 59.3611 32.0477 179.4071 133 V 3.5174 7.7603 118.0276 66.2012 31.4141 178.0465 134 V 3.8023 8.1380 117.5821 66.0577 31.3339 177.8796 135 A 4.1260 8.1391 120.4762 54.9451 18.1946 179.8230 136 G 3.5055 8.2884 104.5354 47.7567 0.0000 176.0633 137 V 2.8975 7.7784 120.4813 65.4797 31.2774 177.7564 138 A 3.8658 7.4505 119.0068 55.3025 18.4682 179.0298 139 N 4.3793 8.4711 114.8634 56.5839 38.6254 177.3651 140 A 3.9603 8.1794 122.3872 55.2064 18.1370 179.2543 141 L 4.0157 7.5780 115.3755 56.5361 42.1191 178.5186 142 A 4.2465 8.1024 120.7267 53.9573 18.4860 178.6167 143 H 4.0150 7.5813 116.6525 59.3955 29.8546 175.9595 144 K 4.5308 7.6929 114.0475 56.3460 31.9673 176.4743 145 Y 4.0906 8.1711 117.8084 58.4737 38.3737 175.8146 146 H 4.4542 8.2295 117.4447 56.1510 28.3410 173.2634 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 V 8.05 3.79 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 0.95 0.00 0.00 0.90 0.00 0.00 2 H 8.12 3.83 0.00 3.28 3.50 0.00 5.72 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.11 4.69 0.00 1.60 1.46 0.85 0.91 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 4 T 8.07 4.27 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 1.22 0.00 0.00 5 P 0.00 4.47 0.00 2.13 2.07 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 6 E 8.28 3.91 0.00 2.13 2.23 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 2.34 2.36 0.00 7 E 7.88 4.02 0.00 2.08 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 2.33 2.34 0.00 8 K 8.87 4.05 0.00 1.77 1.81 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.38 7.81 9 S 8.12 4.64 0.00 4.04 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 10 A 7.43 3.94 1.42 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 0.00 0.00 0.00 11 V 7.37 3.55 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 0.84 0.00 0.00 0.17 0.00 0.00 12 T 7.20 3.93 4.44 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 1.27 0.00 0.00 13 A 8.56 3.97 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 14 L 8.04 3.74 0.00 1.80 1.98 0.10 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.82 4.27 0.00 3.79 3.37 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 16 G 8.84 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 0.00 0.00 0.00 17 K 7.95 4.39 0.00 2.15 2.03 0.00 1.89 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.46 1.44 7.81 18 V 7.39 3.46 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 0.07 0.00 0.00 0.32 0.00 0.00 19 N 8.19 4.50 0.00 2.68 2.57 0.00 0.00 6.82 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 20 V 8.00 3.44 2.06 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 1.05 0.00 0.00 0.89 0.00 0.00 21 D 8.16 4.37 0.00 2.84 2.69 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 E 8.38 4.00 0.00 2.11 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 2.29 2.27 0.00 23 V 8.03 3.55 1.87 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 0.84 0.00 0.00 0.61 0.00 0.00 24 G 8.15 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 0.00 0.00 0.00 25 G 7.71 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 26 E 8.11 3.97 0.00 2.21 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 2.21 2.25 0.00 27 A 7.87 3.93 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 28 L 8.03 3.99 0.00 1.74 1.65 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.98 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.28 4.02 0.00 1.94 1.94 0.00 3.19 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 31 L 7.58 4.18 0.00 1.78 1.84 1.03 0.69 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 32 L 7.56 4.38 0.00 1.81 1.72 0.89 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.77 3.62 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 0.72 0.00 0.00 0.89 0.00 0.00 34 V 7.84 3.52 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 -0.27 0.00 0.00 0.75 0.00 0.00 35 Y 7.36 3.97 0.00 2.59 1.43 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 0.00 36 P 0.00 4.33 0.00 2.27 2.18 0.00 3.78 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 2.18 2.00 0.00 37 W 7.87 4.43 0.00 3.66 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.79 4.20 4.41 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 1.07 0.00 0.00 39 Q 8.39 4.31 0.00 2.39 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 40 R 8.12 4.00 0.00 1.83 2.15 0.00 2.44 0.00 0.00 2.90 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.97 0.00 41 F 8.08 4.33 0.00 2.22 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 42 F 7.45 4.68 0.00 2.98 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 0.00 0.00 0.00 0.00 43 E 8.22 4.09 0.00 2.00 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 0.00 2.41 2.23 0.00 44 S 8.05 4.60 0.00 4.10 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 45 F 8.55 4.53 0.00 3.17 3.16 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 46 G 7.53 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 0.00 0.00 0.00 47 D 8.69 4.49 0.00 2.65 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 48 L 8.29 4.90 0.00 1.66 1.62 1.05 1.04 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 49 S 8.29 4.26 0.00 4.03 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 50 T 7.46 4.68 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 51 P 0.00 4.22 0.00 2.15 2.12 0.00 3.59 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 2.10 2.16 0.00 52 D 7.82 4.35 0.00 2.81 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 53 A 7.70 4.12 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.76 3.77 2.23 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 1.07 0.00 0.00 0.96 0.00 0.00 55 M 8.09 4.18 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 56 G 7.19 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 0.00 0.00 0.00 57 N 7.78 4.39 0.00 3.01 2.73 0.00 0.00 7.08 7.59 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 58 P 0.00 4.26 0.00 2.12 2.04 0.00 3.60 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 59 K 8.87 3.59 0.00 1.47 0.74 0.00 1.70 0.00 0.00 1.16 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.16 1.23 7.81 60 V 7.80 3.74 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 1.05 0.00 0.00 1.04 0.00 0.00 61 K 7.93 3.88 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 A 7.84 3.98 1.31 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 0.00 0.00 0.00 63 H 8.49 4.42 0.00 3.52 3.71 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.29 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 0.00 0.00 0.00 65 K 8.11 3.89 0.00 1.95 2.03 0.00 1.92 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.47 7.81 66 K 7.91 4.01 0.00 2.16 1.93 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.52 7.81 67 V 7.84 3.70 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 1.10 0.00 0.00 0.97 0.00 0.00 68 L 8.35 4.28 0.00 2.03 1.83 0.98 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.70 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 70 A 8.03 4.17 1.45 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 71 F 8.43 4.00 0.00 3.46 3.16 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 72 S 8.65 4.03 0.00 4.31 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 0.00 73 D 8.16 4.58 0.00 2.81 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.83 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 75 L 7.38 4.13 0.00 1.43 1.54 -0.12 0.60 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 76 A 7.52 4.43 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 77 H 7.61 4.84 0.00 3.28 3.38 0.00 5.84 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.10 3.99 0.00 1.58 1.71 0.82 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.95 4.62 0.00 2.65 2.69 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 80 N 8.42 4.99 0.00 2.70 2.65 0.00 0.00 7.17 6.80 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 81 L 7.95 3.97 0.00 1.74 1.79 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.23 3.93 0.00 1.78 1.83 0.00 1.46 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.24 7.81 83 G 7.80 3.70 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 0.00 0.00 0.00 84 T 7.15 3.78 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 0.61 0.00 0.00 85 F 7.99 4.49 0.00 3.00 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 86 A 7.60 4.07 1.42 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 0.00 0.00 0.00 87 T 7.82 3.84 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 88 L 7.93 4.13 0.00 1.85 1.81 0.98 0.88 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 89 S 8.50 4.18 0.00 4.07 4.10 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 90 E 8.14 3.87 0.00 2.28 2.02 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 2.35 2.38 0.00 91 L 7.77 3.95 0.00 1.83 1.96 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.66 4.36 0.00 3.69 3.75 0.00 5.83 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 93 C 7.47 4.07 0.00 1.23 2.23 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 94 D 8.03 4.18 0.00 2.71 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 95 K 7.72 4.10 0.00 1.83 1.81 0.00 1.59 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.49 7.81 96 L 7.58 4.24 0.00 1.79 1.70 0.75 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.38 4.28 0.00 3.47 3.41 0.00 5.64 0.00 0.00 0.00 0.00 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.84 4.08 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 0.17 0.00 0.00 0.69 0.00 0.00 99 D 8.68 4.26 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 0.00 100 P 0.00 2.97 0.00 1.77 1.54 0.00 3.30 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.55 0.00 101 E 8.38 3.92 0.00 2.11 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 2.23 2.33 0.00 102 N 8.36 4.31 0.00 2.58 2.78 0.00 0.00 6.91 8.14 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 0.00 103 F 7.14 4.52 0.00 3.10 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 0.00 104 R 7.58 4.00 0.00 2.16 2.02 0.00 3.27 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 105 L 7.86 3.89 0.00 1.65 1.14 0.55 0.18 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 0.00 106 L 7.80 4.11 0.00 1.81 1.97 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.25 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 0.00 0.00 0.00 108 N 8.65 4.41 0.00 2.97 2.98 0.00 0.00 6.72 7.53 0.00 0.00 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 8.52 3.66 2.37 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 1.14 0.00 0.00 1.17 0.00 0.00 110 L 8.41 3.86 0.00 1.77 1.79 0.74 0.17 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 0.00 111 V 7.87 3.57 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 1.25 0.00 0.00 1.13 0.00 0.00 112 C 8.14 4.07 0.00 3.16 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 V 7.95 3.54 2.13 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 0.96 0.00 0.00 0.89 0.00 0.00 114 L 7.81 3.92 0.00 1.06 1.24 0.48 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.07 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.79 4.21 0.00 3.12 3.51 0.00 5.95 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.76 4.13 0.00 3.38 2.78 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.71 4.53 0.00 2.94 3.15 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 0.00 119 G 8.45 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 0.00 0.00 0.00 120 K 9.02 4.06 0.00 1.82 1.96 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.52 7.81 121 E 8.38 4.04 0.00 2.10 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 0.00 2.37 2.39 0.00 122 F 8.12 4.44 0.00 2.95 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 0.00 123 T 7.34 4.06 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 0.00 124 P 0.00 4.16 0.00 2.15 2.13 0.00 3.57 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 2.11 2.18 0.00 125 P 0.00 4.26 0.00 2.10 2.06 0.00 3.48 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 2.08 2.10 0.00 126 V 7.86 3.61 1.93 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 0.89 0.00 0.00 0.87 0.00 0.00 127 Q 7.93 3.53 0.00 1.69 2.10 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 2.48 2.74 0.00 128 A 7.53 4.03 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 0.00 129 A 7.61 4.01 1.20 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 0.00 130 Y 7.87 3.90 0.00 3.23 3.24 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 0.00 131 Q 8.27 4.22 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.61 0.00 132 K 8.07 3.98 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.61 7.81 133 V 7.76 3.52 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 1.27 0.00 0.00 0.77 0.00 0.00 134 V 8.14 3.80 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 1.08 0.00 0.00 1.27 0.00 0.00 135 A 8.14 4.13 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 0.00 136 G 8.29 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.78 2.90 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 0.06 0.00 0.00 0.16 0.00 0.00 138 A 7.45 3.87 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 0.00 139 N 8.47 4.38 0.00 2.83 2.87 0.00 0.00 6.93 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 0.00 140 A 8.18 3.96 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 0.00 141 L 7.58 4.02 0.00 1.06 1.26 -0.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.10 4.25 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 0.00 143 H 7.58 4.02 0.00 3.27 3.44 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.69 4.53 0.00 1.94 1.87 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.61 7.81 145 Y 8.17 4.09 0.00 3.06 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 0.00 146 H 8.23 4.45 0.00 3.19 3.23 0.00 5.75 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