NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3008 8.3044 118.1915 55.2804 32.3391 174.4764 2 H 4.3596 8.7905 124.2472 54.4880 29.8284 172.5212 3 L 4.6997 7.7169 126.8786 52.4105 45.6817 176.9940 4 T 4.0955 8.2483 112.8027 60.8608 70.9310 174.1053 5 P 4.1974 0.0000 0.0000 65.5372 31.2651 178.9545 6 E 3.9450 8.0289 117.1668 59.4174 29.5071 179.0298 7 E 3.8959 8.1345 118.5384 59.2223 29.5187 179.1633 8 K 3.7843 8.0935 119.7384 59.7701 32.1421 178.9710 9 S 4.0903 8.1633 115.0376 61.4469 62.6104 176.4431 10 A 3.9921 8.0419 123.5426 55.0813 18.0726 179.8346 11 V 3.3257 7.7497 116.5870 66.4779 31.6637 178.3147 12 T 3.9299 8.0613 115.2106 66.5495 68.0876 176.3919 13 A 4.0074 7.9844 121.4950 55.3011 18.8097 179.2072 14 L 3.8744 7.8603 118.6419 57.9278 42.1465 178.8891 15 W 4.4032 8.6422 128.6213 60.3340 30.4230 178.0291 16 G 3.7651 8.0561 104.2342 46.7070 0.0000 174.6878 17 K 4.3905 7.6810 118.5692 55.5647 33.0320 176.7548 18 V 3.6366 7.0104 120.2020 62.2138 32.1482 175.8796 19 N 4.5429 8.2069 125.0705 52.0266 38.8518 175.4358 20 V 3.4960 8.0603 127.9483 66.1155 31.6648 177.2892 21 D 4.3223 8.0675 117.8612 57.2408 40.7533 178.1906 22 E 3.8334 8.2916 119.7153 59.4321 29.6404 179.0763 23 V 3.5708 8.1528 118.8228 65.6099 31.4898 178.1774 24 G 3.7010 8.3164 105.8519 47.8041 0.0000 175.8747 25 G 3.6258 8.0148 108.8789 47.2184 0.0000 175.3272 26 E 3.8626 8.1544 121.5802 58.9493 29.6607 178.8253 27 A 3.9156 8.1937 121.1067 55.0335 18.4610 179.4190 28 L 3.9555 8.0306 119.0449 58.1348 42.2161 179.3428 29 G 3.5654 8.1913 105.7866 48.0241 0.0000 175.9327 30 R 3.9039 8.2654 121.0552 58.5484 30.0140 178.8456 31 L 4.0254 8.0950 120.4067 58.3326 41.9874 179.1875 32 L 4.0238 7.8874 118.7105 57.2437 41.2235 179.6730 33 V 3.5848 7.2503 117.6216 65.7804 31.7367 178.0203 34 V 3.5369 7.8222 116.9544 64.3319 32.7410 175.5248 35 Y 3.8257 7.2453 116.6305 53.9192 37.9086 174.0113 36 P 4.6224 0.0000 0.0000 64.4764 31.6083 178.4051 37 W 4.3204 7.9973 116.4647 59.3724 28.1259 177.7089 38 T 4.2520 7.6372 110.1928 63.8434 68.1760 176.1214 39 Q 4.4026 8.3132 121.6623 58.1152 28.4762 177.9268 40 R 3.6913 7.5632 117.0358 59.1671 29.0993 177.9540 41 F 4.2143 6.9852 115.1515 57.7068 39.3183 176.2065 42 F 4.4579 7.5584 118.1004 56.7649 39.5375 177.4462 43 E 4.0599 8.1710 121.7465 58.9431 29.4750 178.2743 44 S 4.5148 8.0337 112.2474 59.4750 63.5017 174.5671 45 F 4.6405 8.4546 119.6616 58.2245 39.8858 176.9254 46 G 3.9599 7.6096 106.3149 44.4580 0.0000 174.1254 47 D 4.4392 8.6246 124.8370 54.6916 40.8353 175.8563 48 L 4.9034 8.4073 125.5632 54.3313 43.4006 178.6621 49 S 4.2343 8.5098 117.0567 61.0524 63.0957 174.6625 50 T 4.7407 7.3291 106.5710 58.0755 73.1705 172.9365 51 P 4.1967 0.0000 0.0000 65.9308 31.2922 178.6760 52 D 4.3229 8.0610 116.7933 57.3182 40.5761 178.5637 53 A 3.9801 7.7481 120.0741 55.0235 18.7466 179.6434 54 V 3.6722 8.3045 116.9957 66.6262 31.5083 178.2896 55 M 4.1926 8.4845 117.3031 57.6834 31.8489 178.0584 56 G 3.9960 7.7437 103.3343 43.5769 0.0000 173.3141 57 N 4.4540 7.5184 121.4207 52.6231 39.4763 173.9225 58 P 4.2865 0.0000 0.0000 65.8230 31.2527 178.6993 59 K 3.6524 8.4325 118.7512 58.8029 31.8021 179.4890 60 V 3.7049 7.7993 118.1036 66.0122 31.6210 177.9879 61 K 3.9057 8.0147 117.9763 59.5414 31.9178 179.2147 62 A 3.9901 8.0423 120.9411 55.3343 18.1670 179.2338 63 H 4.3598 8.6267 117.2740 59.2822 29.9157 177.6431 64 G 3.6375 8.5738 108.0986 47.7302 0.0000 175.4861 65 K 3.9636 8.1844 121.9994 59.0546 32.3389 178.8849 66 K 3.9552 7.8429 119.4479 59.4226 32.2045 178.9350 67 V 3.6097 7.9947 118.7804 66.1693 31.4788 177.8889 68 L 4.3309 8.4767 120.3168 57.7783 41.8436 179.1650 69 G 3.6892 8.3281 106.0471 47.6572 0.0000 175.6300 70 A 4.1033 8.1011 123.0035 54.7791 18.2215 179.3095 71 F 4.0592 8.2447 118.0587 61.6036 39.8863 176.8117 72 S 4.1664 8.6988 112.8173 61.8045 62.3932 175.9854 73 D 4.5039 8.4935 121.5399 57.2604 40.4826 179.0334 74 G 3.6058 8.0760 106.1720 47.4248 0.0000 175.5696 75 L 3.7633 7.1712 119.3272 56.7225 41.6015 178.3970 76 A 4.2116 7.4624 118.8447 52.9704 19.0956 176.9698 77 H 4.9134 7.8849 115.5543 54.8086 29.8569 175.9683 78 L 3.9897 8.1848 121.3127 58.0187 41.7011 178.9617 79 D 4.4458 7.9616 117.1815 56.7713 41.7251 176.1858 80 N 5.0079 8.3381 117.4530 51.3555 39.2561 174.7191 81 L 4.0475 7.8538 123.2092 57.8413 42.1664 179.3250 82 K 4.0561 8.0823 116.9350 59.5504 31.9163 179.1244 83 G 3.6975 7.9482 105.8975 48.1462 0.0000 175.9080 84 T 3.7295 7.6371 117.2072 65.4210 68.5772 175.7982 85 F 4.7020 8.0737 117.2863 56.9755 39.3207 177.3411 86 A 4.0563 7.5629 121.8839 55.8638 18.1577 180.5738 87 T 3.8759 7.8408 113.5421 66.7746 68.5412 176.9059 88 L 4.0914 7.9554 120.5194 57.6083 41.6928 179.2586 89 S 4.3971 8.4198 114.9560 60.9703 62.4126 175.9906 90 E 3.8730 8.2441 121.1610 59.3436 29.2101 179.1316 91 L 3.9078 8.1139 120.2574 58.6742 42.1046 178.8335 92 H 4.1850 8.5374 116.1296 58.8872 28.6481 177.1303 93 C 3.5673 7.7946 120.7559 62.1690 31.1565 175.3576 94 D 4.3549 8.4237 120.4691 56.5738 40.5703 177.4695 95 K 4.2996 7.8676 116.8942 57.4617 33.6384 177.4854 96 L 4.1683 7.7105 116.3268 54.8922 42.4862 175.9908 97 H 4.1409 7.1242 113.9909 56.6498 26.5270 175.3990 98 V 4.0738 8.0689 118.6769 61.0408 32.3836 174.8152 99 D 4.3765 8.8344 127.4460 53.8100 41.6338 175.1458 100 P 3.2108 0.0000 0.0000 64.5993 31.8101 177.9491 101 E 3.8804 8.1667 119.1346 59.2290 29.2753 178.3745 102 N 4.2802 8.0358 116.6767 56.2861 38.5266 177.2942 103 F 4.4660 7.2899 119.1293 60.5802 38.9238 177.9905 104 R 3.9909 7.9113 117.3631 59.0796 29.9266 178.8245 105 L 3.7999 7.7841 118.7982 57.6580 41.6154 179.2864 106 L 4.0534 8.1805 120.4443 58.0902 42.0263 179.0927 107 G 3.7034 8.1998 105.5940 48.1715 0.0000 175.4219 108 N 4.4816 8.3888 119.1017 55.8574 38.4444 177.8204 109 V 3.6517 8.1376 120.0251 65.7029 31.5543 177.7794 110 L 3.8481 8.5124 120.5461 58.1504 41.8840 179.1447 111 V 3.5434 7.8581 118.0954 66.2417 31.4179 177.7590 112 C 4.0984 8.0063 116.2573 62.7543 27.8816 176.3040 113 V 3.5072 7.9310 119.9514 65.9123 31.0765 178.0762 114 L 3.8282 7.8432 118.5930 57.5805 41.3815 179.3092 115 A 3.6692 7.2978 120.6019 55.3356 18.0865 179.1950 116 H 4.1122 8.0362 115.5999 59.7051 30.0027 176.9578 117 H 3.8797 8.2832 117.3898 58.2074 28.8504 176.9992 118 F 4.7029 8.6274 118.0436 56.5388 39.8120 177.3656 119 G 3.8385 8.7869 109.0638 45.9669 0.0000 177.1825 120 K 4.0463 8.9013 121.7002 59.4914 32.3603 178.1107 121 E 4.1336 8.1476 118.3855 58.5177 29.8478 177.4621 122 F 4.5721 8.1919 123.8666 56.9712 37.9325 175.3217 123 T 4.1784 7.3425 115.7000 60.1692 71.3861 173.4795 124 P 4.1537 0.0000 0.0000 65.6274 31.2940 177.2177 125 P 4.2303 0.0000 0.0000 65.3524 31.2799 178.9108 126 V 3.5277 7.4062 117.3652 65.8416 31.4497 177.7649 127 Q 3.5512 7.9541 119.4117 59.0648 28.8891 178.0876 128 A 4.0102 7.9973 121.4138 55.1858 18.4060 179.4986 129 A 3.8815 7.9707 119.0588 55.6848 18.4357 179.5795 130 Y 3.9000 8.2713 115.1981 61.0856 37.8689 178.7925 131 Q 4.1183 8.8003 119.6395 58.9290 28.7504 178.9957 132 K 3.9688 7.9342 118.9730 59.3597 32.0479 179.5604 133 V 3.5100 7.6936 118.5902 65.9773 31.4985 178.4108 134 V 3.8047 8.2708 119.0545 64.9101 31.1195 178.1845 135 A 4.1165 8.3621 121.6828 54.6187 18.2189 179.7555 136 G 3.5416 8.3270 104.6775 48.0015 0.0000 176.0739 137 V 3.3293 8.1340 121.2428 65.4453 31.4058 177.9235 138 A 3.9123 7.9814 120.4903 55.2621 18.0925 179.4051 139 N 4.2995 8.4086 114.8843 56.3697 38.3838 177.5585 140 A 4.0262 7.8539 121.2637 55.1402 18.7799 179.3860 141 L 3.9931 8.0300 116.6729 56.6468 41.6287 178.4860 142 A 4.5346 7.6572 119.6691 52.7388 19.1505 178.2141 143 H 4.1103 7.8568 117.3037 59.0080 29.9270 175.9315 144 K 4.4477 8.2538 115.6846 56.2074 32.1160 176.3765 145 Y 4.1925 8.0742 117.8495 58.6002 38.4045 175.8004 146 H 4.4079 8.5092 117.2092 56.3551 28.0338 173.5409 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 M 8.30 4.30 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 2 H 8.79 4.36 0.00 3.19 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.72 4.70 0.00 1.51 1.40 0.80 0.86 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 4 T 8.25 4.10 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 1.19 0.00 0.00 5 P 0.00 4.20 0.00 2.15 2.12 0.00 3.57 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 6 E 8.03 3.95 0.00 2.02 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 2.38 2.45 0.00 7 E 8.13 3.90 0.00 2.10 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 2.29 2.27 0.00 8 K 8.09 3.78 0.00 1.91 1.75 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.39 7.81 9 S 8.16 4.09 0.00 4.06 3.89 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 10 A 8.04 3.99 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 11 V 7.75 3.33 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 0.61 0.00 0.00 0.43 0.00 0.00 12 T 8.06 3.93 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 1.25 0.00 0.00 13 A 7.98 4.01 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 14 L 7.86 3.87 0.00 1.98 1.85 0.70 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.64 4.40 0.00 3.85 3.21 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 16 G 8.06 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 0.00 0.00 0.00 17 K 7.68 4.39 0.00 2.00 2.08 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.59 7.81 18 V 7.01 3.64 1.22 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 -0.11 0.00 0.00 0.68 0.00 0.00 19 N 8.21 4.54 0.00 2.72 2.62 0.00 0.00 6.81 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 8.06 3.50 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 1.26 0.00 0.00 0.91 0.00 0.00 21 D 8.07 4.32 0.00 2.85 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 22 E 8.29 3.83 0.00 2.01 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 2.28 2.28 0.00 23 V 8.15 3.57 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 0.94 0.00 0.00 0.63 0.00 0.00 24 G 8.32 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 25 G 8.01 3.63 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 0.00 0.00 0.00 26 E 8.15 3.86 0.00 2.26 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 2.28 2.46 0.00 27 A 8.19 3.92 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 28 L 8.03 3.96 0.00 1.76 1.63 0.91 0.93 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 29 G 8.19 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 30 R 8.27 3.90 0.00 1.88 1.92 0.00 3.08 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 31 L 8.09 4.03 0.00 1.85 1.85 0.99 0.58 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 32 L 7.89 4.02 0.00 2.00 1.67 0.90 0.62 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 33 V 7.25 3.58 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 0.71 0.00 0.00 0.92 0.00 0.00 34 V 7.82 3.54 1.57 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 -0.10 0.00 0.00 0.77 0.00 0.00 35 Y 7.25 3.83 0.00 2.63 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 4.62 0.00 2.33 2.31 0.00 3.78 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 2.19 1.89 0.00 37 W 8.00 4.32 0.00 3.56 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 38 T 7.64 4.25 4.43 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 1.03 0.00 0.00 39 Q 8.31 4.40 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 40 R 7.56 3.69 0.00 1.68 2.02 0.00 2.97 0.00 0.00 2.53 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.50 0.00 41 F 6.99 4.21 0.00 1.57 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 42 F 7.56 4.46 0.00 2.95 2.21 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 43 E 8.17 4.06 0.00 2.17 2.22 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 2.32 2.29 0.00 44 S 8.03 4.51 0.00 4.14 4.12 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 45 F 8.45 4.64 0.00 3.16 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 7.61 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 47 D 8.62 4.44 0.00 2.65 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 48 L 8.41 4.90 0.00 1.73 1.60 1.00 0.91 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 49 S 8.51 4.23 0.00 4.00 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 50 T 7.33 4.74 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.06 4.32 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 53 A 7.75 3.98 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 0.00 0.00 54 V 8.30 3.67 2.19 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 1.06 0.00 0.00 0.97 0.00 0.00 55 M 8.48 4.19 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 56 G 7.74 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 4.45 0.00 2.99 2.82 0.00 0.00 6.85 7.66 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 58 P 0.00 4.29 0.00 2.24 2.26 0.00 3.72 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 2.02 2.02 0.00 59 K 8.43 3.65 0.00 1.69 0.74 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.99 1.16 7.81 60 V 7.80 3.70 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 1.04 0.00 0.00 1.06 0.00 0.00 61 K 8.01 3.91 0.00 1.96 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.63 7.81 62 A 8.04 3.99 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 63 H 8.63 4.36 0.00 3.58 3.50 0.00 5.80 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 8.57 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 65 K 8.18 3.96 0.00 1.90 2.13 0.00 1.65 0.00 0.00 1.96 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.62 7.81 66 K 7.84 3.96 0.00 1.91 2.04 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.51 7.81 67 V 7.99 3.61 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 0.98 0.00 0.00 0.90 0.00 0.00 68 L 8.48 4.33 0.00 2.05 1.80 1.28 0.93 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 69 G 8.33 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 70 A 8.10 4.10 1.57 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 71 F 8.24 4.06 0.00 3.10 3.38 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 72 S 8.70 4.17 0.00 4.65 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 0.00 73 D 8.49 4.50 0.00 2.88 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 74 G 8.08 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 75 L 7.17 3.76 0.00 1.50 1.45 0.04 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.46 4.21 1.10 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 0.00 0.00 77 H 7.88 4.91 0.00 3.19 3.14 0.00 5.83 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 78 L 8.18 3.99 0.00 1.50 1.66 0.72 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.96 4.45 0.00 2.64 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 80 N 8.34 5.01 0.00 2.67 2.58 0.00 0.00 7.07 6.23 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 81 L 7.85 4.05 0.00 1.76 1.85 0.88 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.08 4.06 0.00 1.67 1.82 0.00 1.54 0.00 0.00 0.93 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.44 7.81 83 G 7.95 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 7.64 3.73 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 0.51 0.00 0.00 85 F 8.07 4.70 0.00 3.15 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 86 A 7.56 4.06 1.40 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 0.00 0.00 0.00 87 T 7.84 3.88 4.25 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 1.22 0.00 0.00 88 L 7.96 4.09 0.00 2.02 1.86 1.16 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.42 4.40 0.00 4.17 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 0.00 90 E 8.24 3.87 0.00 2.24 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 0.00 2.30 2.53 0.00 91 L 8.11 3.91 0.00 1.76 1.87 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.54 4.19 0.00 3.53 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.79 3.57 0.00 1.23 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.42 4.35 0.00 2.68 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 95 K 7.87 4.30 0.00 1.81 1.79 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.50 7.81 96 L 7.71 4.17 0.00 1.69 1.64 0.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.12 4.14 0.00 3.55 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.07 4.07 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 0.26 0.00 0.00 0.46 0.00 0.00 99 D 8.83 4.38 0.00 2.78 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 0.00 100 P 0.00 3.21 0.00 1.94 1.85 0.00 3.39 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 101 E 8.17 3.88 0.00 2.04 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 2.31 2.40 0.00 102 N 8.04 4.28 0.00 2.49 2.74 0.00 0.00 6.94 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 0.00 103 F 7.29 4.47 0.00 3.12 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 0.00 104 R 7.91 3.99 0.00 2.04 1.97 0.00 3.34 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 105 L 7.78 3.80 0.00 1.74 1.38 0.73 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.18 4.05 0.00 1.81 1.86 0.92 1.08 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 0.00 107 G 8.20 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 0.00 108 N 8.39 4.48 0.00 2.79 2.95 0.00 0.00 6.71 7.27 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 0.00 109 V 8.14 3.65 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 1.10 0.00 0.00 1.15 0.00 0.00 110 L 8.51 3.85 0.00 1.69 1.75 0.87 0.31 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 0.00 111 V 7.86 3.54 2.31 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 1.31 0.00 0.00 1.16 0.00 0.00 112 C 8.01 4.10 0.00 3.20 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 0.00 113 V 7.93 3.51 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 1.01 0.00 0.00 0.92 0.00 0.00 114 L 7.84 3.83 0.00 1.03 1.15 0.57 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.30 3.67 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 0.00 116 H 8.04 4.11 0.00 3.17 3.44 0.00 5.78 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 0.00 117 H 8.28 3.88 0.00 2.91 2.24 0.00 5.89 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 8.63 4.70 0.00 3.22 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 0.00 119 G 8.79 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 0.00 0.00 0.00 120 K 8.90 4.05 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.53 7.81 121 E 8.15 4.13 0.00 2.17 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 0.00 2.42 2.45 0.00 122 F 8.19 4.57 0.00 3.01 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 0.00 123 T 7.34 4.18 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 1.28 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.23 0.00 2.11 2.06 0.00 3.48 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.41 3.53 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 1.00 0.00 0.00 0.91 0.00 0.00 127 Q 7.95 3.55 0.00 1.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 A 8.00 4.01 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 0.00 129 A 7.97 3.88 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 0.00 130 Y 8.27 3.90 0.00 3.46 3.28 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 0.00 131 Q 8.80 4.12 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 7.93 3.97 0.00 1.96 1.83 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.69 3.51 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 0.94 0.00 0.00 0.75 0.00 0.00 134 V 8.27 3.80 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 0.85 0.00 0.00 1.11 0.00 0.00 135 A 8.36 4.12 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 0.00 136 G 8.33 3.54 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 0.00 137 V 8.13 3.33 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 0.58 0.00 0.00 0.74 0.00 0.00 138 A 7.98 3.91 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 0.00 0.00 139 N 8.41 4.30 0.00 2.95 2.88 0.00 0.00 6.92 7.14 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 0.00 140 A 7.85 4.03 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 0.00 141 L 8.03 3.99 0.00 1.07 0.74 -0.03 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.66 4.53 1.27 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 0.00 0.00 0.00 143 H 7.86 4.11 0.00 3.28 3.57 0.00 5.76 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 0.00 144 K 8.25 4.45 0.00 1.83 1.81 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.76 7.81 145 Y 8.07 4.19 0.00 3.14 2.99 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 0.00 146 H 8.51 4.41 0.00 3.22 3.22 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