NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0450 7.9133 120.3863 62.9602 33.7810 177.5797 2 D 4.2045 7.9523 119.6400 56.6556 40.6227 177.0167 3 A 3.9577 8.2710 122.7994 54.9347 18.8774 179.1128 4 A 3.8698 7.8400 118.8757 55.1256 18.4922 179.6556 5 V 3.4092 8.1550 116.9946 66.3303 31.5243 178.2052 6 A 4.0082 8.1205 120.2259 54.8096 17.8882 179.6149 7 K 3.8189 7.8482 116.8527 59.5514 32.5272 179.4032 8 V 3.7967 7.4596 118.5967 64.7674 31.6484 178.3081 9 C 4.1545 8.2890 116.5878 61.6287 28.0556 174.8252 10 G 3.7253 8.1144 106.9359 45.9152 0.0000 173.7780 11 S 4.6094 7.7386 115.6418 56.5368 63.9176 174.3102 12 E 3.9891 8.7282 129.2924 59.1484 29.2718 179.2127 13 A 3.9477 7.8427 120.6357 55.1165 18.5381 179.5176 14 I 3.5797 7.5389 117.9107 64.4366 37.1589 178.8293 15 K 3.8302 7.9349 118.9479 59.3333 31.7938 179.2193 16 A 3.9856 8.1399 121.0928 55.4151 18.3215 179.5336 17 N 4.3274 8.3128 114.9735 56.2599 38.4910 177.7870 18 L 3.7978 8.0593 120.7730 57.7725 41.5558 179.7971 19 R 4.1111 8.2061 118.3871 59.1714 30.0367 179.3043 20 R 4.0061 8.4369 116.6302 59.1792 29.5540 179.0651 21 S 4.3619 8.3555 115.1385 60.8298 63.1870 176.0659 22 W 4.4839 9.0581 132.6149 60.3300 30.1548 177.7855 23 G 3.7744 8.2956 104.9775 48.0432 0.0000 175.4839 24 V 3.6342 7.3367 118.8375 65.6682 31.6696 177.9678 25 L 3.7376 7.7125 118.9103 57.7922 41.5089 179.3140 26 S 3.7424 7.0040 110.3728 59.1845 62.9918 175.0822 27 A 3.8935 7.5582 124.4329 54.8808 18.5163 177.7287 28 D 4.3715 7.8509 115.2370 52.1294 43.2729 175.7391 29 I 3.5194 8.0663 128.4160 64.0901 37.2700 177.7534 30 E 3.8773 8.0777 119.3336 59.4231 29.5337 178.6450 31 A 3.9423 7.9384 120.6990 55.1090 18.2367 179.7982 32 T 3.7831 7.7781 114.3579 66.6368 68.5451 177.0245 33 G 3.5798 7.7047 108.3550 47.3345 0.0000 175.6637 34 L 3.9917 8.0462 122.3739 57.6425 41.5764 179.4479 35 M 3.9697 8.2942 118.3598 58.2642 32.1256 178.0332 36 L 3.7821 8.0504 120.8910 58.2762 42.2634 178.9617 37 M 3.5748 7.9058 118.5570 58.2794 31.9895 178.6943 38 S 4.1663 8.0778 113.3166 61.5748 62.5935 176.0036 39 N 4.3515 8.2852 119.2119 55.7016 38.1089 177.2907 40 L 3.7345 7.5197 122.0289 58.2090 42.0568 179.0549 41 F 4.5808 7.6389 117.0027 60.0703 38.5791 178.1340 42 T 3.9899 7.6052 115.0785 66.6006 68.5358 176.6882 43 L 4.2438 7.7992 119.4094 56.4199 43.3006 177.8900 44 R 4.7528 8.0782 117.4224 53.0122 30.1905 174.1908 45 P 4.7033 0.0000 0.0000 64.5571 31.9819 178.9290 46 D 4.4893 8.1362 118.0803 55.4961 40.0945 177.8777 47 T 4.4725 8.3059 110.6122 63.5391 68.8781 176.4047 48 K 4.1183 8.1076 122.6435 59.6921 31.7560 178.9301 49 T 3.8889 7.2808 108.5561 64.6375 68.6216 175.7893 50 Y 4.2383 7.6420 118.5357 59.3678 38.3515 175.9106 51 F 4.9719 8.2680 120.3738 57.0181 39.7531 178.0818 52 T 3.8941 7.9637 113.1158 64.7572 69.1413 176.4630 53 R 3.9332 8.0712 121.1144 59.0205 30.1092 177.0352 54 L 4.2500 7.6412 115.4932 55.2679 42.7567 178.6634 55 G 3.8998 7.5926 106.3705 46.1791 0.0000 176.5676 56 D 4.5282 8.3256 121.2684 52.5789 39.6080 176.9922 57 V 3.7221 7.8176 118.2462 62.8588 31.7629 177.8457 58 Q 4.1042 7.5302 116.7899 56.6916 28.6401 177.0188 59 K 4.1005 8.2977 118.0413 56.8272 33.2847 178.3239 60 G 4.0231 7.5766 108.1212 45.7601 0.0000 176.2335 61 K 3.7578 8.9325 121.7430 59.2497 32.2563 178.0640 62 A 3.9772 7.5465 120.1087 54.3681 18.5006 177.3218 63 N 4.6406 8.2587 115.3621 52.4019 38.7919 175.3074 64 S 4.1502 8.5856 124.4880 61.4348 62.9144 176.5767 65 K 3.9976 8.1111 121.4675 59.1951 31.9353 178.9067 66 L 4.0253 8.1740 120.5932 58.0210 42.0358 178.8942 67 R 3.9912 8.3817 119.2254 59.4798 30.0858 178.7776 68 G 3.6412 8.3244 105.5774 47.9445 0.0000 175.0576 69 H 4.1759 8.3731 120.6035 59.0216 30.0169 177.1049 70 A 3.9184 8.5444 122.8083 55.3276 18.2902 179.7044 71 I 3.7159 7.9299 118.2237 64.9186 37.1558 178.9107 72 T 4.1390 8.0228 116.6141 66.5127 68.2739 176.5877 73 L 3.8920 8.1889 122.5819 58.4353 42.0133 179.2332 74 T 3.9425 7.7259 115.2734 66.5435 68.3423 176.3507 75 Y 4.1891 7.9451 118.0068 60.3480 37.7954 178.2817 76 A 3.5928 7.5559 122.0493 54.7411 18.3532 179.6365 77 L 3.6773 7.2644 117.0946 57.5495 41.7236 179.1832 78 N 3.1400 7.5195 117.0514 56.0489 38.6186 176.3349 79 N 4.2052 7.7520 117.2005 56.7562 39.3401 176.1486 80 F 4.6024 7.6497 119.0850 61.1435 38.8329 178.0865 81 V 3.4762 7.6206 117.2655 65.9262 31.0363 177.2474 82 D 4.5300 7.7036 116.4057 55.7088 41.1224 177.5100 83 S 4.6598 7.8910 115.3079 58.4436 63.1159 175.7173 84 L 4.0444 7.4585 122.5604 57.4055 41.3888 177.8183 85 D 4.4004 8.0048 117.0359 55.5310 41.3744 176.0612 86 D 4.6855 8.0490 117.9994 51.0138 43.0979 173.6568 87 P 4.2136 0.0000 0.0000 65.8727 31.4496 178.6766 88 S 4.2671 7.9916 112.2451 61.2533 62.9961 176.3880 89 R 3.8704 7.8254 121.0378 59.1134 29.8520 178.2488 90 L 3.9834 8.1817 120.4860 57.8332 42.0326 178.7071 91 K 3.8631 8.5048 120.2586 59.8056 32.3473 178.5692 92 C 4.1934 8.2580 114.3388 60.7967 29.6499 176.0100 93 V 3.6457 7.9159 121.3762 66.0097 31.1348 178.1724 94 V 3.8834 8.1207 118.1421 66.0887 31.4060 177.8798 95 E 4.0047 8.4741 118.5948 58.9656 29.2212 179.1609 96 K 3.7835 7.9083 119.3148 59.7462 32.3468 179.0536 97 F 4.4790 8.2531 117.4602 60.1276 38.7277 177.6803 98 A 4.0153 8.5755 121.4532 54.9277 18.1596 179.6418 99 V 3.5210 7.7325 116.6539 66.4725 31.5885 178.1138 100 N 4.3915 7.8766 114.4996 56.3911 38.2166 177.0982 101 H 4.2926 7.9191 117.0837 58.4715 28.9516 177.5495 102 I 3.6943 7.9438 121.7508 64.7509 36.7693 178.2542 103 N 4.3892 7.9596 115.6325 55.8388 38.3616 176.6592 104 R 4.3220 7.1804 116.5856 55.1784 30.4270 176.2699 105 K 3.9054 8.1088 117.3846 57.6331 29.8753 175.5854 106 I 4.1156 7.8446 120.1200 59.8678 38.3042 176.9071 107 S 4.7350 8.3551 120.7822 57.1272 65.9480 175.2793 108 G 3.6448 8.5243 108.6845 47.9269 0.0000 175.7361 109 D 4.3653 8.0465 119.6333 57.4159 41.3085 178.2019 110 A 4.1814 7.9698 120.9786 55.0404 18.2581 179.4070 111 F 3.9322 8.6742 119.6782 61.2795 39.6550 177.3698 112 G 3.8860 8.4109 104.6995 47.0755 0.0000 174.9444 113 A 4.1467 7.7603 122.0526 54.5224 18.5471 178.9749 114 I 3.6677 7.4395 117.0866 63.3900 37.8460 178.1195 115 V 3.5858 7.6191 119.1520 66.0428 31.3913 177.7511 116 E 3.9403 8.1032 117.6788 59.0324 29.3933 177.2398 117 P 4.1466 0.0000 0.0000 65.8463 31.3117 178.3227 118 M 3.8263 8.3147 117.1467 58.4525 32.2289 177.8881 119 K 3.8645 8.2928 120.1815 59.9196 32.3349 178.4797 120 E 3.8539 8.1095 118.5620 59.5638 29.2799 179.4566 121 T 3.7835 7.9020 115.8427 66.5354 68.4044 176.8244 122 L 3.9508 7.9535 120.9818 57.5677 41.6738 179.6401 123 K 3.3228 7.5780 118.1540 59.2523 31.7010 179.3025 124 A 4.0198 7.5172 119.4935 54.9128 18.4209 179.3113 125 R 4.1646 8.0212 114.6804 57.7952 30.7489 177.8917 126 M 4.4646 8.4969 117.8298 54.5231 33.0660 177.3763 127 G 3.7437 8.1719 107.9822 46.9772 0.0000 175.1162 128 N 4.5484 8.7048 120.9651 54.2547 38.1590 174.8198 129 Y 4.4963 7.8390 115.7612 58.0683 38.6038 175.4930 130 Y 4.3736 7.7656 121.7299 57.5088 39.6277 174.7248 131 S 4.4328 7.1235 118.2092 55.5269 66.3491 174.7069 132 D 4.2391 8.3288 120.6057 57.0282 40.4979 178.6199 133 D 4.3157 7.8275 119.4210 56.9760 40.7101 178.9050 134 V 3.6117 7.7757 119.1101 66.0006 31.6117 178.0172 135 A 4.3739 8.0145 120.2621 55.1225 18.2399 179.6636 136 G 3.5921 8.5012 104.3791 47.8391 0.0000 175.8845 137 A 3.9383 8.1276 123.1438 54.8115 18.3230 179.8561 138 W 3.9779 8.3454 117.2563 59.6860 29.1950 178.7268 139 A 4.0821 8.4805 120.7665 55.0867 17.5897 179.5276 140 A 3.9685 8.0824 118.7067 55.1096 18.5359 179.2896 141 L 3.9153 7.7191 118.5831 58.0201 42.1008 179.1796 142 V 3.9146 8.3541 118.7911 65.9934 31.4204 178.2186 143 G 3.6330 8.1236 105.2984 47.5882 0.0000 175.9157 144 V 3.5037 7.2707 119.8124 65.8090 31.7460 178.0521 145 V 3.5175 7.4572 117.4968 66.0671 31.3173 177.8317 146 Q 3.8403 8.1786 117.5786 58.7950 28.2932 178.4853 147 A 4.0768 7.8098 120.1263 53.6420 18.5875 178.2689 148 A 4.4209 7.7510 117.5843 51.9383 19.7250 176.9238 149 L 4.1641 7.4407 122.8223 54.6471 41.8878 176.4069 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 7.91 4.05 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 0.91 0.00 0.00 0.93 0.00 0.00 2 D 7.95 4.20 0.00 2.79 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 3 A 8.27 3.96 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 4 A 7.84 3.87 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 5 V 8.15 3.41 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 1.07 0.00 0.00 0.90 0.00 0.00 6 A 8.12 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 7 K 7.85 3.82 0.00 1.93 1.85 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.58 7.81 8 V 7.46 3.80 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 0.78 0.00 0.00 0.79 0.00 0.00 9 C 8.29 4.15 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.11 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 11 S 7.74 4.61 0.00 3.88 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 12 E 8.73 3.99 0.00 2.03 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 2.36 0.00 13 A 7.84 3.95 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 14 I 7.54 3.58 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.58 0.78 0.00 0.00 15 K 7.93 3.83 0.00 1.86 1.81 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.53 7.81 16 A 8.14 3.99 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 17 N 8.31 4.33 0.00 2.80 2.88 0.00 0.00 7.08 6.33 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 18 L 8.06 3.80 0.00 1.60 1.32 0.56 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.21 4.11 0.00 2.00 2.04 0.00 3.15 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 20 R 8.44 4.01 0.00 2.03 2.35 0.00 2.78 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.67 0.00 21 S 8.36 4.36 0.00 4.36 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 0.00 22 W 9.06 4.48 0.00 3.74 3.41 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 23 G 8.30 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 24 V 7.34 3.63 2.17 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 1.02 0.00 0.00 0.93 0.00 0.00 25 L 7.71 3.74 0.00 1.60 1.06 0.79 0.64 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 26 S 7.00 3.74 0.00 3.64 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 27 A 7.56 3.89 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 28 D 7.85 4.37 0.00 2.61 2.42 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 29 I 8.07 3.52 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.04 0.50 0.00 0.00 30 E 8.08 3.88 0.00 2.04 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 0.00 2.37 2.39 0.00 31 A 7.94 3.94 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 32 T 7.78 3.78 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 33 G 7.70 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.05 3.99 0.00 1.62 1.71 0.93 1.15 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 35 M 8.29 3.97 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.45 0.00 36 L 8.05 3.78 0.00 1.93 1.54 0.78 1.06 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 37 M 7.91 3.57 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.75 0.00 38 S 8.08 4.17 0.00 3.91 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 39 N 8.29 4.35 0.00 2.85 2.74 0.00 0.00 6.67 6.49 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 40 L 7.52 3.73 0.00 1.43 0.93 0.81 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.64 4.58 0.00 3.12 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 42 T 7.61 3.99 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 43 L 7.80 4.24 0.00 1.67 1.71 0.90 0.65 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 44 R 8.08 4.75 0.00 1.96 1.98 0.00 3.61 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 45 P 0.00 4.70 0.00 2.24 2.38 0.00 3.99 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 46 D 8.14 4.49 0.00 2.89 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.31 4.47 4.71 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 1.39 0.00 0.00 48 K 8.11 4.12 0.00 1.94 1.81 0.00 1.42 0.00 0.00 1.48 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.66 1.26 7.81 49 T 7.28 3.89 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 1.12 0.00 0.00 50 Y 7.64 4.24 0.00 2.58 2.65 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 0.00 0.00 0.00 0.00 51 F 8.27 4.97 0.00 3.16 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 52 T 7.96 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 1.27 0.00 0.00 53 R 8.07 3.93 0.00 1.82 2.06 0.00 3.27 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 54 L 7.64 4.25 0.00 1.74 1.75 1.00 1.00 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 55 G 7.59 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 0.00 0.00 0.00 56 D 8.33 4.53 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 3.72 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 0.60 0.00 0.00 0.14 0.00 0.00 58 Q 7.53 4.10 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.96 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 59 K 8.30 4.10 0.00 1.87 1.84 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.51 7.81 60 G 7.58 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 61 K 8.93 3.76 0.00 1.73 1.88 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.47 7.81 62 A 7.55 3.98 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 63 N 8.26 4.64 0.00 2.76 2.93 0.00 0.00 6.80 8.47 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 64 S 8.59 4.15 0.00 4.10 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 65 K 8.11 4.00 0.00 2.14 1.94 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.52 7.81 66 L 8.17 4.03 0.00 1.82 1.89 1.03 0.99 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 67 R 8.38 3.99 0.00 2.04 1.94 0.00 3.18 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 68 G 8.32 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 69 H 8.37 4.18 0.00 3.38 3.65 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 70 A 8.54 3.92 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 71 I 7.93 3.72 1.97 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 1.57 1.17 1.16 0.00 0.00 72 T 8.02 4.14 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 1.32 0.00 0.00 73 L 8.19 3.89 0.00 1.58 1.83 0.89 1.04 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 74 T 7.73 3.94 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 1.35 0.00 0.00 75 Y 7.95 4.19 0.00 3.24 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.56 3.59 0.49 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 0.00 0.00 0.00 77 L 7.26 3.68 0.00 1.72 1.74 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 N 7.52 3.14 0.00 2.59 2.90 0.00 0.00 6.80 6.34 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 79 N 7.75 4.21 0.00 2.90 2.87 0.00 0.00 7.28 6.55 0.00 0.00 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 F 7.65 4.60 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 81 V 7.62 3.48 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 0.96 0.00 0.00 0.83 0.00 0.00 82 D 7.70 4.53 0.00 2.93 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 S 7.89 4.66 0.00 4.03 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.46 4.04 0.00 1.56 1.68 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.00 4.40 0.00 2.66 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 86 D 8.05 4.69 0.00 2.66 2.51 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 87 P 0.00 4.21 0.00 2.17 2.08 0.00 3.63 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 88 S 7.99 4.27 0.00 4.04 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 0.00 89 R 7.83 3.87 0.00 1.95 2.13 0.00 3.11 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 90 L 8.18 3.98 0.00 1.94 1.76 0.81 0.77 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 91 K 8.50 3.86 0.00 1.84 1.95 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.43 7.81 92 C 8.26 4.19 0.00 3.19 3.17 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 93 V 7.92 3.65 2.45 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 1.47 0.00 0.00 1.15 0.00 0.00 94 V 8.12 3.88 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 0.94 0.00 0.00 0.70 0.00 0.00 95 E 8.47 4.00 0.00 2.17 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 2.31 2.40 0.00 96 K 7.91 3.78 0.00 1.78 1.96 0.00 1.32 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.05 0.75 7.81 97 F 8.25 4.48 0.00 3.42 3.29 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 98 A 8.58 4.02 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 99 V 7.73 3.52 2.24 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 1.00 0.00 0.00 0.91 0.00 0.00 100 N 7.88 4.39 0.00 2.97 2.86 0.00 0.00 7.09 8.04 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 0.00 101 H 7.92 4.29 0.00 3.56 3.43 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.94 3.69 2.00 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 1.51 0.86 0.91 0.00 0.00 103 N 7.96 4.39 0.00 2.87 2.89 0.00 0.00 7.10 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.18 4.32 0.00 2.07 1.90 0.00 3.43 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.74 0.00 105 K 8.11 3.91 0.00 2.00 2.01 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 106 I 7.84 4.12 2.00 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.80 0.92 0.00 0.00 107 S 8.36 4.73 0.00 4.07 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 0.00 108 G 8.52 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 0.00 109 D 8.05 4.37 0.00 2.68 2.79 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 0.00 110 A 7.97 4.18 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 0.00 111 F 8.67 3.93 0.00 3.28 3.23 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 0.00 112 G 8.41 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 0.00 0.00 0.00 113 A 7.76 4.15 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 0.00 114 I 7.44 3.67 1.53 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.29 0.72 0.00 0.00 115 V 7.62 3.59 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 1.12 0.00 0.00 1.04 0.00 0.00 116 E 8.10 3.94 0.00 2.00 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 2.41 2.35 0.00 117 P 0.00 4.15 0.00 2.12 1.95 0.00 3.63 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 2.08 0.00 118 M 8.31 3.83 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 119 K 8.29 3.86 0.00 1.96 1.94 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.65 7.81 120 E 8.11 3.85 0.00 2.14 1.88 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 2.40 2.43 0.00 121 T 7.90 3.78 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 1.07 0.00 0.00 122 L 7.95 3.95 0.00 1.89 1.94 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.58 3.32 0.00 1.66 1.52 0.00 1.50 0.00 0.00 1.40 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.50 0.47 7.81 124 A 7.52 4.02 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 0.00 125 R 8.02 4.16 0.00 1.78 1.93 0.00 3.05 0.00 0.00 3.10 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 126 M 8.50 4.46 0.00 2.32 2.42 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.63 0.00 127 G 8.17 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 0.00 128 N 8.70 4.55 0.00 2.42 2.63 0.00 0.00 6.71 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Y 7.84 4.50 0.00 3.21 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 0.00 130 Y 7.77 4.37 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.12 4.43 0.00 3.86 3.75 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 D 8.33 4.24 0.00 2.68 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 0.00 133 D 7.83 4.32 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 0.00 134 V 7.78 3.61 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 1.24 0.00 0.00 0.91 0.00 0.00 135 A 8.01 4.37 1.58 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 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.50 3.59 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 0.00 0.00 0.00 137 A 8.13 3.94 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 0.00 138 W 8.35 3.98 0.00 3.53 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 0.00 139 A 8.48 4.08 1.44 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 0.00 0.00 0.00 140 A 8.08 3.97 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 0.00 141 L 7.72 3.92 0.00 1.54 1.76 0.57 0.44 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 0.00 142 V 8.35 3.91 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 1.26 0.00 0.00 1.20 0.00 0.00 143 G 8.12 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 0.00 144 V 7.27 3.50 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.80 0.00 0.00 145 V 7.46 3.52 1.74 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 0.35 0.00 0.00 0.81 0.00 0.00 146 Q 8.18 3.84 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.66 2.71 0.00 147 A 7.81 4.08 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 0.00 148 A 7.75 4.42 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 0.00 149 L 7.44 4.16 0.00 1.51 1.52 0.53 0.66 0.00 0.00 0.00 0.00 0.00 0.00 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