NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 5.0820 0.0000 0.0000 63.0155 31.9969 176.0194 2 I 4.0633 8.3636 119.0688 59.5870 37.9778 170.0490 3 V 4.5553 8.1783 118.4669 59.7503 35.2034 175.2474 4 D 4.9450 8.4793 119.3275 52.8751 39.9830 175.1419 5 T 4.6569 7.5713 107.7580 61.8584 72.6877 175.6999 6 G 3.9549 9.3786 110.3848 46.1516 0.0000 174.6309 7 S 4.6190 8.2749 117.1879 56.8339 65.2059 173.2537 8 V 4.4617 7.8821 116.8946 58.9124 34.8440 175.7579 9 A 4.1553 8.3191 124.8939 51.4145 18.8829 175.9517 10 P 4.4267 0.0000 0.0000 62.2939 32.0695 176.3756 11 L 4.4043 8.1266 120.6226 54.3679 42.5625 178.0201 12 S 4.4626 9.0680 118.7341 57.5399 65.6081 175.0930 13 A 3.9700 8.6438 124.6944 55.6131 17.9777 180.0545 14 A 3.9566 7.9330 118.4070 55.4605 18.5589 179.5710 15 E 3.9717 7.9491 117.1061 59.3877 29.4038 179.7580 16 K 3.9783 8.1302 118.5627 59.7581 32.1485 179.4694 17 T 3.8686 7.8102 115.6301 66.5079 68.3963 176.5029 18 K 3.9566 8.0677 121.4727 59.5719 32.1256 178.8431 19 I 3.9036 7.9884 119.9326 64.5860 37.1200 178.4716 20 R 4.0810 8.2940 119.0663 59.5269 29.7002 179.2796 21 S 4.1615 7.9984 113.2331 61.7659 62.9829 176.4762 22 A 4.1410 8.0010 121.9561 54.5959 18.2660 179.3145 23 W 4.3065 8.9139 127.3077 60.6555 30.8894 177.8704 24 A 4.0192 8.1868 120.8423 55.0973 17.5637 177.7053 25 P 4.1428 0.0000 0.0000 65.7058 31.4791 178.7390 26 V 3.5389 7.4398 116.3574 66.1571 31.4673 177.3517 27 Y 3.9321 7.4903 119.3055 60.4336 38.2809 177.6201 28 S 4.0725 7.7971 115.9049 60.6315 63.8296 175.1303 29 T 4.4651 7.3517 109.8213 59.9793 68.9786 175.1369 30 Y 4.1211 7.8123 123.2089 61.5211 37.7083 177.6914 31 E 4.2343 7.1705 118.2489 58.7324 29.6587 178.9985 32 T 3.8919 7.7940 116.9202 66.1547 68.8962 176.9424 33 S 4.2142 8.0063 116.5733 61.6901 62.8397 176.8137 34 G 3.7945 8.5675 108.4533 48.0004 0.0000 175.7726 35 V 3.6187 7.3538 120.8013 65.7140 31.4739 177.7558 36 D 4.3785 8.1911 118.5805 57.4456 40.6751 178.8910 37 I 3.7689 8.0888 120.4524 64.3990 37.1349 178.3165 38 L 4.1229 8.2374 121.3049 58.0940 41.8545 179.1040 39 V 3.5858 8.1961 118.6099 65.8443 31.4935 177.7157 40 K 3.9020 8.3414 119.5932 59.5531 31.7950 178.3105 41 F 4.1559 8.1083 119.2845 61.3008 39.3918 176.2670 42 F 3.7995 8.7099 120.8464 61.6234 38.9285 177.2778 43 T 3.8429 8.1248 108.2902 64.3826 68.6881 175.6489 44 S 4.5662 7.6738 114.0181 58.0997 65.0473 174.9281 45 T 4.4588 7.0196 119.1032 60.7274 69.2917 172.1633 46 P 4.4804 0.0000 0.0000 64.5831 32.0632 178.7313 47 A 3.9415 7.9780 119.2255 55.0964 18.5002 178.3669 48 A 3.9922 7.5813 117.9866 54.2680 19.1892 179.3994 49 Q 4.0305 7.5244 115.3848 59.1101 28.7971 179.0830 50 E 4.0171 7.9387 114.0377 58.5093 29.6497 177.3701 51 F 4.5111 8.1547 117.1721 57.9299 39.5093 176.1399 52 F 4.6028 8.0012 120.5828 54.2119 38.8325 173.6356 53 P 4.2704 0.0000 0.0000 65.6414 31.6624 178.7979 54 K 4.3477 8.0468 114.5114 58.1726 32.3079 177.3438 55 F 4.7778 8.4660 117.6968 57.0169 39.5111 175.7921 56 K 4.1989 7.7887 121.0810 58.0931 32.2909 175.3770 57 G 4.2814 9.2704 114.5505 46.2998 0.0000 174.4095 58 L 4.4517 8.0357 119.6932 53.9913 42.1323 176.7363 59 T 4.5279 8.8674 111.7461 62.2103 71.2134 174.9080 60 T 4.4833 8.1019 111.7987 59.8424 71.8236 175.2952 61 A 3.9866 8.5299 124.0171 55.7535 17.8813 179.9637 62 D 4.2642 7.9910 116.5969 57.4952 40.8379 178.6509 63 E 3.9364 7.8066 118.3471 59.2952 29.4697 179.3509 64 L 3.7480 7.7826 118.7943 57.8486 41.5453 179.9029 65 K 3.9363 8.0804 116.8286 58.7512 32.0111 178.6327 66 K 4.3090 7.3848 116.2545 55.7415 32.7626 176.5219 67 S 4.2794 7.5471 115.9323 57.1811 62.9572 174.6586 68 A 4.0677 8.6571 129.8896 55.2385 18.1093 179.1269 69 D 4.4658 8.0516 117.1662 57.5837 41.0028 178.9400 70 V 3.4263 7.2814 117.4651 65.9632 31.3848 178.2634 71 R 3.9777 8.1050 117.8233 59.0368 29.9292 178.8636 72 W 4.7114 8.6600 128.4063 60.9090 30.7322 177.5063 73 H 4.0011 8.5233 118.0125 59.2060 29.3563 177.0833 74 A 4.0851 8.3374 122.6441 55.3496 18.3205 179.5058 75 E 4.1704 8.6401 117.3167 59.5363 29.2913 179.9100 76 R 3.7058 7.4864 117.4411 59.0454 30.4041 178.8103 77 I 3.8560 7.7109 119.5590 64.5468 37.2174 178.2101 78 I 3.9188 7.9779 119.3500 64.5143 37.8035 177.5707 79 N 4.5179 8.2612 116.3270 55.8015 38.1976 177.3462 80 A 3.9748 7.8793 122.6872 54.9815 18.4518 179.8505 81 V 3.3398 7.6978 116.4182 65.9400 31.5927 177.5166 82 D 4.0386 8.1159 117.8403 57.4407 40.7851 177.9979 83 D 4.2153 7.8639 118.0239 57.1788 41.1812 178.3976 84 A 3.9679 7.4724 121.2030 54.9855 18.2622 179.7768 85 V 3.2495 7.3998 116.4794 66.0977 31.3413 178.1698 86 A 4.0843 7.9346 118.8241 54.1571 18.3001 178.6802 87 S 4.5830 7.3829 112.2081 58.6150 62.9876 175.7831 88 M 3.9292 7.5538 123.8940 58.4760 31.7926 177.4724 89 D 4.5323 7.9427 116.2277 55.4125 41.9196 176.0634 90 D 4.8309 7.9028 119.7610 51.5367 40.9032 175.6412 91 T 3.8224 7.9239 117.4850 64.5759 67.6292 174.5531 92 E 3.8610 8.0254 120.9115 59.0867 29.7986 178.5253 93 K 3.8985 7.9019 119.5292 59.5661 32.2395 178.2815 94 M 3.9151 7.9088 118.4543 58.7562 32.0932 178.3640 95 S 4.0129 7.9926 115.0319 61.8458 63.1160 176.3606 96 M 3.9586 7.8060 121.1350 58.4594 31.8900 178.8033 97 K 3.8897 7.9036 119.3716 59.6387 32.3158 178.8690 98 L 4.0039 7.8865 119.1789 57.5833 41.4721 179.6823 99 R 3.8691 8.4226 118.7662 59.0352 29.9320 178.5103 100 N 4.2223 8.0337 116.7871 56.6114 38.9662 176.6804 101 L 3.9738 7.6790 121.2980 58.0611 42.1008 178.7377 102 S 4.1566 8.4321 113.6540 61.4152 62.2844 176.2781 103 G 3.5573 7.9567 108.2673 47.8335 0.0000 175.7153 104 K 3.5899 7.7177 120.3872 59.3866 32.0832 179.2253 105 H 4.3156 8.2145 116.2412 58.6806 28.4043 177.8544 106 A 3.5311 7.7323 121.7841 54.7885 18.3153 179.4127 107 K 4.0133 7.9450 115.7953 58.5879 32.4817 178.3699 108 S 4.4436 7.3328 112.7635 60.3986 63.8401 175.6317 109 F 4.5926 7.5519 117.3788 58.4001 39.2295 175.6555 110 Q 3.5619 7.7500 117.9362 56.9217 26.3750 173.9676 111 V 3.8353 7.6073 109.1912 59.5933 33.4263 176.2043 112 D 4.1811 6.6624 123.0828 53.3037 41.4040 175.4526 113 P 3.3000 0.0000 0.0000 64.9426 30.8719 178.1675 114 E 3.7140 7.4026 116.6038 59.1129 29.7189 177.9536 115 Y 4.4468 6.9568 116.2120 59.0619 38.0441 177.4302 116 F 4.3986 7.3279 120.3254 60.6234 39.1393 177.6491 117 K 4.0737 8.1261 117.5165 59.5687 32.2389 179.2854 118 V 3.6818 7.6993 119.5206 65.9552 31.7012 177.5856 119 L 3.7496 7.8696 119.8537 57.9421 41.7510 178.5925 120 A 4.0282 8.2590 120.6394 55.1194 18.1716 179.4058 121 A 4.0006 8.0482 119.2375 55.3802 18.4820 180.0207 122 V 3.6348 7.6308 116.8035 66.2027 31.5904 178.2847 123 I 3.8360 8.0542 119.2910 64.3850 36.9513 178.2320 124 A 4.3521 8.5308 121.8669 55.4389 18.0753 178.9934 125 D 4.3186 8.2954 115.5517 57.9450 41.2817 178.5551 126 T 4.0629 7.7912 115.1283 66.4905 68.6169 176.9339 127 V 3.7167 7.7307 118.6044 64.6153 33.1745 177.0439 128 A 4.4960 7.7407 119.8716 50.6192 20.9002 174.1218 129 A 4.1748 7.9643 123.3075 53.3875 19.2066 177.9788 130 G 4.0174 8.9879 111.2468 45.6130 0.0000 173.7395 131 D 4.3986 8.0148 119.4413 54.1528 41.9312 176.7084 132 A 4.1974 8.8102 129.7828 54.9181 18.4954 179.4226 133 G 3.5302 8.0604 104.0722 48.1112 0.0000 175.6308 134 F 4.0684 8.5980 123.7354 60.8504 39.5075 177.0311 135 E 3.9752 8.2668 117.9305 59.0751 29.1757 179.2622 136 K 3.8916 7.9615 119.8560 59.2722 32.3130 178.6247 137 L 3.7480 7.6241 120.5331 58.4650 41.9122 178.8657 138 M 3.8631 7.8492 118.6993 58.3898 31.7155 179.0082 139 S 4.2704 7.9854 116.6483 61.2056 62.9826 176.5079 140 M 3.9594 8.0373 121.4060 58.4303 31.6258 178.8682 141 I 3.5296 7.5943 119.6946 64.6239 37.0594 178.3324 142 C 3.9723 7.8765 116.2162 62.7662 28.0831 175.9297 143 I 3.8187 7.9668 121.6945 64.4298 36.8060 178.5569 144 L 3.9687 7.8157 119.7916 57.6082 41.2288 179.4000 145 L 3.8752 7.8364 117.8782 56.6396 41.7195 178.5632 146 R 4.6647 7.4800 117.2701 56.3798 30.3794 178.0947 147 S 4.1715 7.7064 114.0283 61.1836 62.8348 174.9989 148 A 4.2803 7.9966 122.3328 52.5177 18.9153 176.7079 149 Y 4.1578 8.1128 119.2477 58.0875 37.9907 175.3898 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 P 0.00 5.08 0.00 2.22 2.00 0.00 3.33 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 2 I 8.36 4.06 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.91 0.00 0.00 3 V 8.18 4.56 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 0.94 0.00 0.00 0.91 0.00 0.00 4 D 8.48 4.94 0.00 2.72 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 5 T 7.57 4.66 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 1.19 0.00 0.00 6 G 9.38 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.27 4.62 0.00 3.77 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 8 V 7.88 4.46 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 0.76 0.00 0.00 0.88 0.00 0.00 9 A 8.32 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.43 0.00 2.03 1.97 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 11 L 8.13 4.40 0.00 1.60 1.57 0.84 0.84 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 12 S 9.07 4.46 0.00 4.04 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 13 A 8.64 3.97 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 14 A 7.93 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 7.95 3.97 0.00 2.15 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 2.35 2.36 0.00 16 K 8.13 3.98 0.00 1.98 1.85 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.66 7.81 17 T 7.81 3.87 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 18 K 8.07 3.96 0.00 2.01 1.95 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.67 7.81 19 I 7.99 3.90 2.10 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 1.86 0.85 1.06 0.00 0.00 20 R 8.29 4.08 0.00 2.03 2.07 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.99 0.00 21 S 8.00 4.16 0.00 4.06 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 22 A 8.00 4.14 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 23 W 8.91 4.31 0.00 3.59 3.35 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 24 A 8.19 4.02 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.14 0.00 1.97 2.09 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.14 0.00 26 V 7.44 3.54 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 0.75 0.00 0.00 0.85 0.00 0.00 27 Y 7.49 3.93 0.00 2.15 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 28 S 7.80 4.07 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 29 T 7.35 4.47 4.11 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 1.10 0.00 0.00 30 Y 7.81 4.12 0.00 3.22 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.17 4.23 0.00 2.09 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 0.00 2.05 2.12 0.00 32 T 7.79 3.89 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 1.17 0.00 0.00 33 S 8.01 4.21 0.00 3.84 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 34 G 8.57 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 35 V 7.35 3.62 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 1.08 0.00 0.00 1.02 0.00 0.00 36 D 8.19 4.38 0.00 2.92 2.73 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 37 I 8.09 3.77 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.85 1.02 0.00 0.00 38 L 8.24 4.12 0.00 1.84 1.72 1.10 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.20 3.59 2.16 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 1.04 0.00 0.00 0.94 0.00 0.00 40 K 8.34 3.90 0.00 2.06 2.04 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.51 7.81 41 F 8.11 4.16 0.00 3.15 3.42 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 42 F 8.71 3.80 0.00 3.12 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 43 T 8.12 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 1.37 0.00 0.00 44 S 7.67 4.57 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 7.02 4.46 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 46 P 0.00 4.48 0.00 2.07 1.99 0.00 3.77 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 47 A 7.98 3.94 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 48 A 7.58 3.99 0.79 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 49 Q 7.52 4.03 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.76 0.00 0.00 0.00 0.00 0.00 1.16 1.84 0.00 50 E 7.94 4.02 0.00 1.80 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 1.99 1.47 0.00 51 F 8.15 4.51 0.00 3.00 2.86 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 52 F 8.00 4.60 0.00 3.00 1.76 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 53 P 0.00 4.27 0.00 2.19 2.15 0.00 3.54 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 54 K 8.05 4.35 0.00 1.96 2.07 0.00 1.83 0.00 0.00 1.82 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.51 7.81 55 F 8.47 4.78 0.00 3.19 2.77 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 56 K 7.79 4.20 0.00 1.84 1.85 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.26 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.63 7.81 57 G 9.27 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 0.00 0.00 0.00 58 L 8.04 4.45 0.00 1.68 1.51 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.87 4.53 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 1.25 0.00 0.00 60 T 8.10 4.48 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 1.25 0.00 0.00 61 A 8.53 3.99 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 62 D 7.99 4.26 0.00 2.76 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 63 E 7.81 3.94 0.00 2.12 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 2.31 2.33 0.00 64 L 7.78 3.75 0.00 1.73 1.42 0.90 0.06 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 65 K 8.08 3.94 0.00 1.65 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.63 7.81 66 K 7.38 4.31 0.00 1.81 1.81 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.53 7.81 67 S 7.55 4.28 0.00 3.71 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 68 A 8.66 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.05 4.47 0.00 2.77 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 70 V 7.28 3.43 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 0.70 0.00 0.00 -0.12 0.00 0.00 71 R 8.11 3.98 0.00 2.09 2.07 0.00 3.20 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 72 W 8.66 4.71 0.00 3.44 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 73 H 8.52 4.00 0.00 3.58 3.63 0.00 5.66 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 74 A 8.34 4.09 1.47 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 0.00 0.00 75 E 8.64 4.17 0.00 2.45 2.32 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 2.67 2.62 0.00 76 R 7.49 3.71 0.00 1.61 1.73 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.51 0.00 77 I 7.71 3.86 2.06 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 1.48 1.13 0.97 0.00 0.00 78 I 7.98 3.92 2.15 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 1.19 0.00 0.00 79 N 8.26 4.52 0.00 2.90 2.82 0.00 0.00 6.89 7.08 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 80 A 7.88 3.97 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 81 V 7.70 3.34 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 0.54 0.00 0.00 0.93 0.00 0.00 82 D 8.12 4.04 0.00 2.89 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 83 D 7.86 4.22 0.00 2.79 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 84 A 7.47 3.97 1.13 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 85 V 7.40 3.25 1.72 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 0.82 0.00 0.00 -0.02 0.00 0.00 86 A 7.93 4.08 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 7.38 4.58 0.00 3.81 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 88 M 7.55 3.93 0.00 1.91 2.09 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 2.81 2.41 0.00 89 D 7.94 4.53 0.00 2.64 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 90 D 7.90 4.83 0.00 2.58 2.46 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 0.00 0.00 0.00 0.00 91 T 7.92 3.82 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 1.18 0.00 0.00 92 E 8.03 3.86 0.00 2.05 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 0.00 2.35 2.34 0.00 93 K 7.90 3.90 0.00 1.94 1.87 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.41 7.81 94 M 7.91 3.92 0.00 2.20 1.97 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 2.49 2.49 0.00 95 S 7.99 4.01 0.00 4.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 M 7.81 3.96 0.00 2.06 2.21 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 2.80 2.53 0.00 97 K 7.90 3.89 0.00 1.95 1.74 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.45 7.81 98 L 7.89 4.00 0.00 1.73 1.58 0.79 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.42 3.87 0.00 1.97 1.93 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 100 N 8.03 4.22 0.00 2.93 2.97 0.00 0.00 6.84 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.68 3.97 0.00 1.98 1.76 1.01 0.69 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 0.00 102 S 8.43 4.16 0.00 4.07 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 0.00 103 G 7.96 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 7.72 3.59 0.00 1.77 1.01 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.52 7.81 105 H 8.21 4.32 0.00 3.65 3.84 0.00 5.81 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 0.00 106 A 7.73 3.53 0.40 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 0.00 107 K 7.94 4.01 0.00 1.53 1.76 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.47 7.81 108 S 7.33 4.44 0.00 3.22 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 0.00 109 F 7.55 4.59 0.00 3.15 2.96 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 0.00 110 Q 7.75 3.56 0.00 2.36 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 111 V 7.61 3.84 1.71 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 0.78 0.00 0.00 0.97 0.00 0.00 112 D 6.66 4.18 0.00 2.25 2.30 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 0.00 113 P 0.00 3.30 0.00 1.79 0.70 0.00 3.47 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.48 0.00 114 E 7.40 3.71 0.00 1.78 1.79 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 1.72 1.47 0.00 115 Y 6.96 4.45 0.00 2.86 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 0.00 116 F 7.33 4.40 0.00 2.97 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 0.00 117 K 8.13 4.07 0.00 2.00 2.10 0.00 1.51 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.52 7.81 118 V 7.70 3.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 1.10 0.00 0.00 119 L 7.87 3.75 0.00 0.74 1.54 0.73 0.85 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 0.00 120 A 8.26 4.03 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 0.00 121 A 8.05 4.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.63 3.63 2.36 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 1.20 0.00 0.00 1.17 0.00 0.00 123 I 8.05 3.84 2.21 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.74 1.30 0.00 0.00 124 A 8.53 4.35 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.30 4.32 0.00 2.90 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 0.00 126 T 7.79 4.06 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 1.22 0.00 0.00 127 V 7.73 3.72 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 0.55 0.00 0.00 1.22 0.00 0.00 128 A 7.74 4.50 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.96 4.17 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 0.00 130 G 8.99 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 0.00 0.00 0.00 131 D 8.01 4.40 0.00 2.86 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.81 4.20 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 0.00 133 G 8.06 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 0.00 134 F 8.60 4.07 0.00 3.34 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 0.00 135 E 8.27 3.98 0.00 2.29 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 0.00 2.41 2.58 0.00 136 K 7.96 3.89 0.00 1.97 1.90 0.00 1.61 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.41 7.81 137 L 7.62 3.75 0.00 1.49 1.24 0.38 0.79 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 0.00 138 M 7.85 3.86 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.32 0.00 139 S 7.99 4.27 0.00 3.99 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 0.00 140 M 8.04 3.96 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.51 0.00 141 I 7.59 3.53 1.86 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.59 0.73 0.00 0.00 142 C 7.88 3.97 0.00 3.01 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 0.00 143 I 7.97 3.82 1.94 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 1.46 1.00 0.87 0.00 0.00 144 L 7.82 3.97 0.00 1.74 1.62 0.83 0.60 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 0.00 145 L 7.84 3.88 0.00 1.08 0.38 0.35 0.70 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 0.00 146 R 7.48 4.66 0.00 1.94 1.98 0.00 3.28 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 147 S 7.71 4.17 0.00 4.05 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 0.00 148 A 8.00 4.28 1.17 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 0.00 0.00 149 Y 8.11 4.16 0.00 3.14 2.91 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