NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 S 4.3062 8.3231 116.7923 58.6196 64.1594 173.4930 0 G 4.1766 9.2858 117.4111 43.3115 0.0000 171.6508 1 M 4.7626 7.5154 118.6229 52.2839 35.0311 172.6427 2 A 4.0825 8.5278 122.3164 52.0143 19.5206 176.4029 3 L 5.0435 8.1632 122.1175 52.8960 45.1478 176.0622 4 F 4.9984 9.2791 121.0141 55.1867 42.8317 174.8570 5 S 4.8262 9.0039 116.9518 58.9073 62.9934 173.6637 6 A 4.7741 9.0556 123.5001 52.4675 20.9078 176.3604 7 Q 4.4941 7.8525 113.5040 54.7355 31.8791 173.9791 8 S 4.3075 8.4031 119.9734 57.7242 63.5398 172.6078 9 P 4.6801 0.0000 0.0000 63.2268 32.3759 175.2160 10 Y 4.7161 8.7241 119.5930 57.5273 39.0396 174.4852 11 I 4.7626 8.5683 125.3468 60.1305 39.3341 175.8210 12 N 4.5812 9.1689 123.8710 52.4219 36.6184 173.1608 13 P 4.3470 0.0000 0.0000 62.6032 32.4119 176.4107 14 I 4.0161 8.2878 122.0123 61.1302 37.7846 175.5165 15 I 4.4788 8.1443 126.3832 59.2950 38.3919 173.8064 16 P 4.6942 0.0000 0.0000 62.8280 32.3580 175.1272 17 F 4.9292 9.3169 124.9858 56.8039 41.9957 174.2242 18 T 4.7459 7.5368 121.3666 61.6846 71.5387 173.3064 19 G 3.9059 8.5310 112.3009 43.9162 0.0000 170.1006 20 P 5.0169 0.0000 0.0000 62.5287 32.5001 176.6745 21 I 4.2281 8.8601 125.3541 59.5872 38.2914 175.3622 22 Q 4.1181 8.8307 128.0205 57.2730 28.4001 177.4438 23 G 3.8126 8.9356 111.6854 44.9888 0.0000 173.8708 24 G 4.6576 8.0779 103.7310 44.6000 0.0000 173.6972 25 L 4.3409 8.4037 118.6742 54.8330 42.5175 176.6838 26 Q 4.8392 8.2695 118.1855 53.7466 31.7730 174.2276 27 E 3.8268 8.8534 120.3309 57.9640 30.0876 177.4479 28 G 3.9465 9.3806 114.3011 45.0558 0.0000 172.6959 29 L 4.3967 7.8730 123.2842 55.1812 43.5229 175.4928 30 Q 5.1603 9.7352 125.7259 54.2622 31.5157 174.5335 31 V 4.7515 9.0444 125.1509 61.5718 33.7391 174.3242 32 T 5.1986 8.7215 124.9936 61.7610 71.6117 173.0789 33 L 5.0102 9.4768 127.0374 52.9090 44.6229 175.0909 34 Q 4.3862 7.7670 125.0666 54.4790 31.4765 174.5871 35 G 3.5110 6.9050 112.5535 46.4187 0.0000 171.4854 36 T 5.1885 7.9430 116.1172 62.1406 73.3375 174.0323 37 T 4.2966 8.3760 115.0284 61.2670 70.5310 174.5102 38 K 4.2686 8.7238 123.4757 55.6031 33.0192 178.5207 39 S 3.9176 8.2314 116.5003 60.8150 63.0781 175.0515 40 F 4.6276 6.9636 113.4196 56.1667 38.1465 175.6125 41 A 4.1155 7.1575 125.1662 53.0119 18.9226 177.0860 42 Q 4.7085 8.8562 121.8414 57.2293 31.9271 175.3502 43 R 5.1765 7.9226 114.6546 54.7202 34.5276 174.2745 44 F 5.0855 8.2464 115.1442 55.4864 42.3331 173.3368 45 V 4.6155 9.0133 118.4861 61.1004 35.1154 174.0222 46 V 4.7982 8.7627 127.1217 61.1361 34.1090 173.6943 47 N 5.2466 9.1839 125.3957 51.4374 41.7846 173.4790 48 F 5.1029 9.1703 123.4225 56.1101 40.8844 174.9877 49 Q 4.9478 9.3143 121.7033 54.5542 32.9125 173.4483 50 N 4.8963 8.7775 119.0418 52.7798 39.7780 175.8168 51 S 3.9800 9.2317 123.3566 57.1274 63.6313 170.8295 52 F 4.4090 8.3364 113.8162 59.0492 37.9653 176.3846 53 N 4.1801 6.7265 116.9441 53.4858 37.3785 176.3947 54 G 3.8673 8.0895 105.7989 45.6130 0.0000 173.8005 55 N 4.3523 7.8760 117.9915 54.8765 40.1050 174.2605 56 D 5.0780 7.9555 117.6119 52.5281 44.2455 174.9155 57 I 4.7210 8.5129 125.5708 59.2003 39.0665 176.6291 58 A 4.2483 8.9228 130.7104 54.8098 19.2354 177.6133 59 F 5.0417 8.2898 118.2852 57.6790 42.7562 172.6192 60 H 5.1571 9.7390 127.7831 54.4039 31.9965 172.7044 61 F 4.6236 8.6441 128.8393 56.4786 41.6290 173.5799 62 N 5.0852 8.0846 125.2473 49.2675 39.9130 170.2510 63 P 4.0889 0.0000 0.0000 61.9354 33.0142 175.0323 64 R 4.3011 8.3095 122.9172 53.5884 32.9813 176.2786 65 F 4.8530 8.6282 128.2524 56.3730 36.5790 175.3960 66 E 4.7551 7.3128 118.7096 55.5338 33.9591 175.6825 67 E 3.9856 10.2123 117.9404 57.4803 27.2378 176.0432 68 G 3.9232 8.2216 107.8451 44.2685 0.0000 175.0715 69 G 4.0225 8.9800 108.6180 45.7767 0.0000 172.4168 70 Y 5.1875 8.2045 121.6014 56.4235 42.3200 173.6260 71 V 4.3945 8.7623 118.8468 60.9818 34.9699 174.0004 72 V 4.7107 8.1014 127.4242 61.4177 33.7241 173.9772 73 C 5.7953 9.0276 125.1188 57.4773 31.4251 172.6351 74 N 5.5962 8.3145 119.7724 54.0439 42.7593 172.4364 75 T 5.4487 8.9215 115.7973 61.6255 72.9231 173.0818 76 K 4.8689 9.1566 126.4910 54.6139 35.1614 174.6932 77 Q 4.7146 8.5653 125.5164 54.4959 32.3579 175.3944 78 N 4.1836 10.2903 123.0192 54.4021 36.7728 175.5098 79 G 3.7315 8.2820 103.7805 45.5268 0.0000 173.8374 80 Q 4.5197 7.6065 119.3165 53.2994 30.8772 175.1390 81 W 4.7690 8.6661 123.1530 57.0584 30.0192 176.8158 82 G 4.3635 8.7452 111.4374 44.6112 0.0000 170.6754 83 P 4.6493 0.0000 0.0000 62.6799 31.8262 176.4619 84 E 4.4302 8.9428 124.0738 56.3788 30.7106 175.8985 85 E 4.7400 9.2954 122.9781 54.8024 31.9466 175.0789 86 R 5.1498 8.6942 123.4846 54.1930 33.0370 175.1247 87 K 4.3462 8.8936 125.2069 54.5698 33.9614 176.5481 88 M 4.8360 8.3055 130.6604 53.0684 30.5290 175.2045 89 Q 4.5325 7.4663 119.7250 55.1433 32.5718 172.6002 90 M 4.3400 8.5058 123.5982 53.2409 33.0597 173.4540 91 P 4.2858 0.0000 0.0000 63.1255 32.1622 176.0847 92 F 4.9050 7.5211 117.4986 56.1371 41.2427 174.8454 93 Q 4.8269 8.4905 120.9376 53.6280 31.6272 175.5158 94 K 3.6333 8.5457 121.8830 57.9990 32.4294 177.1013 95 G 4.2492 8.3265 110.1206 44.9443 0.0000 172.9482 96 M 4.9457 7.5666 118.7181 52.1245 35.2184 173.8699 97 P 4.8226 0.0000 0.0000 63.3496 32.4524 175.2985 98 F 5.2521 8.4537 115.1472 55.5942 42.0304 172.4519 99 E 5.0433 9.7060 121.7399 54.3757 32.2208 174.2309 100 L 5.1726 9.5061 128.9189 53.4306 45.2204 174.3363 101 C 5.2790 9.0291 127.1055 57.5827 34.6004 172.2717 102 F 5.2132 9.6423 125.5105 55.8502 40.9313 174.2228 103 L 4.9856 9.3105 127.2005 53.4072 44.1677 175.3513 104 V 3.8107 8.8246 127.6753 62.3256 32.0782 175.2108 105 Q 4.6317 8.4934 127.6449 53.8563 31.3248 177.0473 106 R 4.2657 8.7491 120.2579 59.1502 30.2071 177.1390 107 S 4.7569 7.9607 109.8737 58.4252 64.7632 172.8159 108 E 4.8107 7.3771 119.8828 54.9975 34.5021 174.1403 109 F 4.9569 9.0727 120.7277 56.9936 40.9164 174.9816 110 K 5.1086 9.1862 122.2452 54.6751 35.0380 175.2141 111 V 4.6452 8.9055 124.8685 61.3406 34.0766 173.9236 112 M 5.0828 8.9039 127.9192 53.5123 34.9812 175.0028 113 V 4.4886 8.5785 122.9865 61.3523 34.3950 175.3625 114 N 4.2444 9.8417 126.8112 54.5234 36.5019 175.3880 115 K 4.0387 8.2780 113.5208 56.4849 30.4626 176.4413 116 K 4.6588 7.5765 119.1920 53.8847 34.2074 175.6022 117 F 4.4847 8.8852 125.2872 58.7423 40.0336 173.0527 118 F 4.8012 8.2815 128.9456 59.1274 40.9917 175.4213 119 V 4.2126 6.5743 116.3571 60.1045 34.5078 172.7394 120 Q 5.3209 8.7774 119.8971 55.0325 31.7173 174.3461 121 Y 4.6351 9.0384 121.4155 55.9192 41.9229 174.3227 122 Q 4.1924 8.3319 126.3625 55.8674 29.6044 176.3418 123 H 4.3908 8.4368 121.5020 56.5825 29.1324 175.7021 124 R 4.3805 8.7907 122.8464 57.0142 31.0471 176.7016 125 V 4.6210 7.4835 108.5979 58.2744 35.2826 173.3804 126 P 4.2262 0.0000 0.0000 62.7972 31.7287 177.5984 127 Y 4.3345 7.9588 121.0545 59.6713 38.3521 177.2960 128 H 4.7422 7.4767 114.2519 56.9666 28.9986 176.4055 129 L 3.9019 7.1367 119.1932 56.8605 41.7801 177.1249 130 V 4.2304 8.0921 120.7864 62.6840 32.2698 175.7049 131 D 5.1995 9.1097 125.8715 53.2373 41.2163 175.2797 132 T 5.1885 7.9118 115.4510 62.1752 73.1951 172.2743 133 I 4.8064 9.0289 125.6503 59.1220 41.0497 173.9878 134 A 5.1454 8.8345 130.0049 50.1143 22.3626 174.8700 135 V 4.9784 9.2180 122.6338 61.1186 34.6796 174.6585 136 S 4.9294 9.4882 121.2769 56.8641 67.1962 172.1030 137 G 4.3594 8.7989 105.5444 43.8456 0.0000 174.6058 138 C 4.6478 8.5254 117.9605 58.4467 27.1750 172.8326 139 L 4.8456 7.8000 122.0623 54.3284 43.3959 174.5503 140 K 4.7274 8.8463 118.2761 54.9847 36.2465 174.8351 141 L 4.7975 8.0281 119.9094 53.2199 44.7359 177.8234 142 S 4.2673 9.0513 120.3485 61.3837 64.0888 174.0796 143 F 5.2150 6.9817 111.3088 56.2542 40.8911 172.9809 144 I 5.2443 9.0558 121.1623 59.8787 40.1724 175.1141 145 T 4.8294 8.9150 117.0994 59.9067 72.4327 173.4733 146 F 5.2882 8.5190 119.5509 56.1238 42.6483 173.9700 147 Q 5.3182 9.4001 122.4841 54.5205 33.4292 174.4196 148 T 5.3385 9.1623 114.0413 59.1763 72.8297 174.8397 149 Q 4.8420 8.6073 118.8810 54.9820 28.2725 177.1310 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 8.32 4.31 0.00 3.86 3.94 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 0 G 9.29 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 0.00 0.00 0.00 0.00 1 M 7.52 4.76 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 A 8.53 4.08 1.21 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 0.00 0.00 3 L 8.16 5.04 0.00 1.40 1.52 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 4 F 9.28 5.00 0.00 2.90 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 9.00 4.83 0.00 3.93 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 6 A 9.06 4.77 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 7 Q 7.85 4.49 0.00 1.82 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.91 0.00 0.00 0.00 0.00 0.00 1.89 2.07 0.00 8 S 8.40 4.31 0.00 3.85 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 9 P 0.00 4.68 0.00 2.06 1.99 0.00 3.74 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 1.96 1.92 0.00 10 Y 8.72 4.72 0.00 2.99 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.57 4.76 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 1.01 0.00 0.00 12 N 9.17 4.58 0.00 2.75 2.81 0.00 0.00 6.98 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 13 P 0.00 4.35 0.00 1.38 1.30 0.00 3.85 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 1.71 1.60 0.00 14 I 8.29 4.02 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.58 0.95 0.00 0.00 15 I 8.14 4.48 1.89 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 1.46 0.94 0.99 0.00 0.00 16 P 0.00 4.69 0.00 2.10 2.08 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 17 F 9.32 4.93 0.00 3.28 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 18 T 7.54 4.75 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 19 G 8.53 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 20 P 0.00 5.02 0.00 2.03 2.05 0.00 3.93 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 2.13 2.17 0.00 21 I 8.86 4.23 2.02 0.00 0.00 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 1.60 0.88 1.05 0.00 0.00 22 Q 8.83 4.12 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 23 G 8.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.08 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.40 4.34 0.00 2.23 1.71 1.16 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.27 4.84 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 7.06 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 27 E 8.85 3.83 0.00 2.06 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 2.28 2.28 0.00 28 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 29 L 7.87 4.40 0.00 1.96 1.65 1.12 0.74 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 30 Q 9.74 5.16 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 31 V 9.04 4.75 2.48 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 0.99 0.00 0.00 1.32 0.00 0.00 32 T 8.72 5.20 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 33 L 9.48 5.01 0.00 1.77 1.64 1.22 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.77 4.39 0.00 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.50 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 35 G 6.90 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 36 T 7.94 5.19 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 1.16 0.00 0.00 37 T 8.38 4.30 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 0.94 0.00 0.00 38 K 8.72 4.27 0.00 0.79 0.74 0.00 1.47 0.00 0.00 1.45 0.00 0.00 2.75 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.25 1.10 7.81 39 S 8.23 3.92 0.00 3.92 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 40 F 6.96 4.63 0.00 3.09 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 41 A 7.16 4.12 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 42 Q 8.86 4.71 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 43 R 7.92 5.18 0.00 1.64 1.59 0.00 3.15 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.59 0.00 44 F 8.25 5.09 0.00 3.22 2.95 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 45 V 9.01 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 0.97 0.00 0.00 0.86 0.00 0.00 46 V 8.76 4.80 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 0.44 0.00 0.00 1.15 0.00 0.00 47 N 9.18 5.25 0.00 2.57 2.73 0.00 0.00 6.50 8.01 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 48 F 9.17 5.10 0.00 3.02 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 49 Q 9.31 4.95 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 50 N 8.78 4.90 0.00 2.76 2.75 0.00 0.00 7.23 7.01 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 51 S 9.23 3.98 0.00 4.05 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 52 F 8.34 4.41 0.00 3.12 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 53 N 6.73 4.18 0.00 2.56 2.05 0.00 0.00 7.02 6.88 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 54 G 8.09 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 0.00 0.00 0.00 55 N 7.88 4.35 0.00 2.65 2.74 0.00 0.00 6.75 9.28 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 56 D 7.96 5.08 0.00 2.49 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 57 I 8.51 4.72 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.84 1.09 0.00 0.00 58 A 8.92 4.25 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 59 F 8.29 5.04 0.00 2.78 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 H 9.74 5.16 0.00 3.55 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.64 4.62 0.00 2.40 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 62 N 8.08 5.09 0.00 2.17 2.28 0.00 0.00 7.06 8.28 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 63 P 0.00 4.09 0.00 0.49 1.16 0.00 2.44 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.21 0.00 64 R 8.31 4.30 0.00 0.67 1.29 0.00 2.35 0.00 0.00 3.02 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.16 0.00 65 F 8.63 4.85 0.00 3.00 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 66 E 7.31 4.76 0.00 2.04 1.86 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 2.32 2.31 0.00 67 E 10.21 3.99 0.00 2.19 2.01 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 2.26 2.38 0.00 68 G 8.22 3.92 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 0.00 0.00 0.00 69 G 8.98 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 70 Y 8.20 5.19 0.00 3.19 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 71 V 8.76 4.39 2.26 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 0.27 0.00 0.00 0.76 0.00 0.00 72 V 8.10 4.71 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 0.96 0.00 0.00 0.95 0.00 0.00 73 C 9.03 5.80 0.00 3.05 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.31 5.60 0.00 2.74 2.77 0.00 0.00 7.44 7.22 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 75 T 8.92 5.45 4.52 0.00 0.00 0.00 0.00 0.00 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 76 K 9.16 4.87 0.00 0.79 1.13 0.00 1.30 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 0.21 7.81 77 Q 8.57 4.71 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.04 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 78 N 10.29 4.18 0.00 2.75 2.83 0.00 0.00 7.13 7.44 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 79 G 8.28 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 80 Q 7.61 4.52 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 81 W 8.67 4.77 0.00 3.21 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 82 G 8.75 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.65 0.00 2.14 2.13 0.00 3.88 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 2.06 2.05 0.00 84 E 8.94 4.43 0.00 1.89 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 2.24 2.29 0.00 85 E 9.30 4.74 0.00 2.11 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 2.31 2.43 0.00 86 R 8.69 5.15 0.00 1.65 1.87 0.00 3.06 0.00 0.00 2.92 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 87 K 8.89 4.35 0.00 1.61 1.56 0.00 1.31 0.00 0.00 0.83 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.30 7.81 88 M 8.31 4.84 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 89 Q 7.47 4.53 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.83 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 90 M 8.51 4.34 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.52 0.00 91 P 0.00 4.29 0.00 1.41 1.54 0.00 3.36 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.44 0.00 92 F 7.52 4.91 0.00 3.08 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 93 Q 8.49 4.83 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.04 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 94 K 8.55 3.63 0.00 1.46 1.47 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.24 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.35 0.22 7.81 95 G 8.33 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 0.00 0.00 0.00 0.00 96 M 7.57 4.95 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.82 0.00 97 P 0.00 4.82 0.00 1.99 1.94 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 1.97 1.93 0.00 98 F 8.45 5.25 0.00 3.33 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 99 E 9.71 5.04 0.00 2.00 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 2.21 2.20 0.00 100 L 9.51 5.17 0.00 2.06 1.76 0.40 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 101 C 9.03 5.28 0.00 2.97 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 0.00 102 F 9.64 5.21 0.00 3.10 3.09 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 0.00 0.00 0.00 0.00 103 L 9.31 4.99 0.00 1.78 1.62 1.00 0.73 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 0.00 104 V 8.82 3.81 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 -0.42 0.00 0.00 0.81 0.00 0.00 105 Q 8.49 4.63 0.00 2.10 1.96 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 2.26 2.25 0.00 106 R 8.75 4.27 0.00 1.80 1.99 0.00 3.23 0.00 0.00 3.63 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 107 S 7.96 4.76 0.00 4.01 4.07 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 0.00 108 E 7.38 4.81 0.00 1.96 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 0.00 2.23 2.27 0.00 109 F 9.07 4.96 0.00 2.81 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 0.00 110 K 9.19 5.11 0.00 1.80 1.97 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.62 7.81 111 V 8.91 4.65 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 0.16 0.00 0.00 1.17 0.00 0.00 112 M 8.90 5.08 0.00 1.95 1.91 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 2.56 2.62 0.00 113 V 8.58 4.49 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 0.13 0.00 0.00 0.48 0.00 0.00 114 N 9.84 4.24 0.00 2.77 2.83 0.00 0.00 7.16 7.36 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 0.00 115 K 8.28 4.04 0.00 1.94 2.01 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.35 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.45 7.81 116 K 7.58 4.66 0.00 1.95 1.74 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.34 7.81 117 F 8.89 4.48 0.00 3.02 3.01 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 0.00 118 F 8.28 4.80 0.00 2.76 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 0.00 119 V 6.57 4.21 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 1.08 0.00 0.00 0.82 0.00 0.00 120 Q 8.78 5.32 0.00 2.17 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.66 0.00 121 Y 9.04 4.64 0.00 2.75 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.33 4.19 0.00 1.70 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 123 H 8.44 4.39 0.00 3.22 3.53 0.00 5.64 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 0.00 124 R 8.79 4.38 0.00 1.94 2.05 0.00 3.32 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 125 V 7.48 4.62 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 0.81 0.00 0.00 1.08 0.00 0.00 126 P 0.00 4.23 0.00 2.11 1.86 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 127 Y 7.96 4.33 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 0.00 128 H 7.48 4.74 0.00 3.29 3.20 0.00 5.14 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.14 3.90 0.00 1.82 1.75 0.68 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.09 4.23 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 1.31 0.00 0.00 1.24 0.00 0.00 131 D 9.11 5.20 0.00 2.88 2.87 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 0.00 132 T 7.91 5.19 4.42 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 1.26 0.00 0.00 133 I 9.03 4.81 1.98 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.14 1.35 0.00 0.00 134 A 8.83 5.15 1.21 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 0.00 0.00 135 V 9.22 4.98 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 1.16 0.00 0.00 0.98 0.00 0.00 136 S 9.49 4.93 0.00 3.93 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 0.00 137 G 8.80 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 C 8.53 4.65 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.80 4.85 0.00 1.59 1.31 0.85 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.85 4.73 0.00 1.73 1.84 0.00 1.18 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.17 1.24 7.81 141 L 8.03 4.80 0.00 1.43 1.38 0.80 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 S 9.05 4.27 0.00 3.41 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 0.00 143 F 6.98 5.22 0.00 3.08 3.06 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 0.00 0.00 0.00 0.00 144 I 9.06 5.24 2.06 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.96 0.74 0.00 0.00 145 T 8.91 4.83 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 0.99 0.00 0.00 146 F 8.52 5.29 0.00 2.99 3.06 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 0.00 0.00 0.00 0.00 147 Q 9.40 5.32 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.68 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 148 T 9.16 5.34 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 1.30 0.00 0.00 149 Q 8.61 4.84 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.68 0.00 0.00 0.00 0.00 0.00 2.28 1.88 0.00