NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0289 8.0544 120.3930 63.3010 31.6778 174.7668 2 H 4.0508 8.8294 126.7437 57.7279 30.3035 170.0228 3 L 3.8148 7.8606 128.2494 53.9985 41.6762 174.2790 4 T 4.2969 8.3613 113.8801 60.1484 69.8470 173.7874 5 P 4.2441 0.0000 0.0000 66.1736 30.8707 178.1953 6 E 4.0013 8.0956 116.2316 58.6181 29.7773 178.7288 7 E 3.9118 8.1067 120.2167 59.1228 29.6382 178.9086 8 K 4.0435 7.8834 119.2274 59.0363 32.2272 178.5878 9 S 4.0365 8.2763 113.6937 61.4240 62.4541 176.0857 10 A 3.9623 8.0565 123.4202 55.2267 18.1230 179.7987 11 V 3.3785 8.2035 117.1373 66.1165 31.5884 178.3439 12 T 4.0959 8.0320 115.1407 66.1733 68.3553 176.7364 13 A 4.0557 8.0004 121.7856 55.3231 18.5585 179.5070 14 L 3.8248 7.6641 115.8916 57.6567 41.7172 179.3953 15 W 4.3224 8.5154 128.5008 60.5529 30.3761 178.1980 16 G 3.7392 8.0414 104.3307 47.1092 0.0000 174.2938 17 K 4.3234 7.9498 118.4788 56.4351 32.4805 176.6114 18 V 3.9684 7.0931 120.2076 61.3183 32.0850 174.9826 19 N 4.2987 8.4180 125.8501 53.6371 37.9655 175.4088 20 V 3.6491 7.9956 125.9609 63.6602 31.9433 176.9583 21 D 4.4683 8.2095 119.2011 55.6648 41.5375 176.0392 22 E 4.4500 8.0497 116.0867 58.2609 31.4025 177.8861 23 V 3.6779 7.7204 117.5450 66.2758 31.2784 178.2546 24 G 3.7273 8.0732 104.8323 47.8524 0.0000 175.8198 25 G 3.6513 8.6068 108.7489 47.3931 0.0000 175.7202 26 E 3.9834 8.1624 120.2043 59.0632 29.5025 179.1785 27 A 3.9261 8.0042 120.9626 55.0210 18.4674 179.5296 28 L 3.9484 7.8080 118.7983 58.0498 42.1124 179.2144 29 G 3.6059 8.0011 105.7295 47.9810 0.0000 175.8124 30 R 3.8233 7.8902 120.7649 58.5861 29.9986 178.5527 31 L 3.9936 8.3342 120.5367 58.5336 41.8900 179.1760 32 L 4.0033 7.8644 119.8271 57.0976 41.3048 179.8544 33 V 3.4872 7.6397 117.2111 66.1471 31.6667 178.0844 34 V 3.5160 7.8056 116.8536 64.2988 32.7841 175.5464 35 Y 3.8766 7.5227 116.7394 54.1615 37.8681 174.1538 36 P 4.6139 0.0000 0.0000 64.2171 31.8349 178.3863 37 W 4.4194 8.3260 116.9269 59.7909 27.3746 177.9415 38 T 4.3992 7.7060 110.3057 64.3367 68.1646 176.4287 39 Q 4.2662 8.2396 121.7687 58.9369 28.4377 178.7717 40 R 3.9816 7.7966 115.9674 58.9385 29.3421 178.0798 41 F 4.2856 7.8290 115.7945 57.9297 39.4379 175.8362 42 F 4.4355 8.2464 117.0385 56.8023 40.4606 176.7693 43 E 4.1093 8.2150 123.6102 59.1534 29.6726 179.1921 44 S 4.2302 8.4673 113.0183 61.6197 62.6111 175.9142 45 F 4.2775 8.2569 118.0290 58.5411 39.8012 177.0278 46 G 3.9559 7.9010 107.4162 45.0457 0.0000 175.2638 47 D 4.4692 8.6960 126.8788 54.5739 40.1671 175.4291 48 L 4.8779 8.2764 127.4949 54.6191 42.8061 179.3574 49 S 4.2776 8.1389 117.3390 60.6853 63.2286 175.0794 50 T 4.7267 7.1499 106.3833 58.7444 72.6833 173.2530 51 P 4.2869 0.0000 0.0000 65.4059 31.1524 178.4959 52 D 4.3805 8.0270 117.0699 56.2776 40.8427 178.1460 53 A 4.0381 8.2922 121.2600 55.3273 18.7524 179.6533 54 V 3.6919 7.4988 115.7538 66.6120 31.5294 178.2707 55 M 4.3112 8.2173 116.7494 57.1957 31.7681 177.9223 56 G 4.0910 7.3388 104.1027 43.3459 0.0000 173.2766 57 N 4.5845 7.6933 120.9551 52.3521 40.0432 174.0875 58 P 4.3112 0.0000 0.0000 65.6908 31.6072 178.7180 59 K 3.7561 8.1650 118.5783 58.9400 31.6764 179.4228 60 V 3.8245 7.8492 118.8341 65.8682 31.3487 178.2510 61 K 3.9837 7.9965 117.9593 59.7694 32.1962 178.9625 62 A 3.9832 8.0463 122.1143 55.1869 18.3183 179.0991 63 H 4.3398 8.6219 117.0938 59.1418 30.0002 177.6029 64 G 3.7673 8.5100 107.9909 47.7590 0.0000 175.5121 65 K 4.0845 8.0053 121.5691 58.9945 31.9674 179.1246 66 K 3.9846 7.5488 117.1413 59.3291 32.2779 179.1036 67 V 3.8761 7.8263 118.3505 66.1288 31.5561 177.7748 68 L 4.4162 8.3208 120.2138 58.2178 41.9010 178.9818 69 G 3.8166 8.2985 105.5691 48.0341 0.0000 175.5133 70 A 4.0992 8.2398 123.0621 54.6982 18.3098 179.8343 71 F 3.7548 8.3837 116.0785 60.8536 39.1076 177.6911 72 S 4.1028 8.6079 114.7915 61.7968 62.3902 176.6610 73 D 4.3933 7.9858 120.7802 57.3056 40.8809 178.6927 74 G 3.7798 8.0012 106.1895 47.8034 0.0000 175.6585 75 L 3.8773 7.9861 120.6175 57.5207 41.6654 179.3053 76 A 4.2172 8.2000 119.9791 54.2706 18.6710 177.2235 77 H 4.9461 8.1296 115.1368 55.0170 30.0595 175.6133 78 L 4.0683 8.4070 121.7802 57.9417 41.5425 178.4155 79 D 4.5757 7.9260 115.1761 54.4723 40.6753 176.5026 80 N 5.0238 8.4095 118.9086 51.8461 40.0549 174.4668 81 L 4.1313 7.8914 121.3821 57.8194 42.5272 178.3557 82 K 3.9491 8.3497 117.7569 59.8698 31.7912 178.8404 83 G 3.7049 9.2272 105.3925 48.6061 0.0000 175.5098 84 T 3.6606 7.5642 116.5728 65.2320 68.6146 175.5743 85 F 4.4726 7.9700 117.2664 56.6001 39.6410 176.8641 86 A 3.9910 7.6832 123.3113 55.7682 18.1094 180.3298 87 T 3.9246 7.7884 107.4929 64.6538 69.0046 176.8509 88 L 4.0038 7.8344 121.3884 57.7247 41.7787 178.7514 89 S 4.0817 8.7581 113.3171 61.5951 62.1372 175.7554 90 E 3.9159 8.1331 121.7662 59.2630 29.5031 178.8403 91 L 3.9033 8.0018 120.1292 58.7843 42.2339 178.7435 92 H 4.3188 8.6432 116.3064 59.1214 28.6910 176.8688 93 C 4.4809 8.4352 120.7963 61.3093 27.7133 175.6889 94 D 4.1924 7.7506 121.5779 57.6234 40.9911 178.4700 95 K 4.0499 7.9244 118.0286 59.3153 32.4958 177.8368 96 L 4.2733 7.6713 116.9188 55.4652 42.0023 176.7659 97 H 4.3628 8.0105 113.9313 56.7605 26.3110 175.2277 98 V 3.6794 7.8832 119.1293 62.4500 32.0863 175.0986 99 D 4.1791 8.4789 126.6579 53.4794 41.7816 175.2146 100 P 3.0211 0.0000 0.0000 64.2560 32.0274 178.0969 101 E 3.9051 8.4283 119.5788 59.2813 29.3827 178.4315 102 N 4.4447 8.2198 116.5053 55.7662 38.5272 177.3813 103 F 4.5275 7.3955 119.5030 60.6814 38.9651 177.7123 104 R 4.0248 7.9867 117.1668 59.2688 29.8741 178.9413 105 L 3.8904 7.8327 118.5533 57.6721 41.6070 179.2142 106 L 4.0923 8.1569 120.3951 58.2731 41.9948 179.3285 107 G 3.7605 8.3527 105.5874 47.9763 0.0000 175.4756 108 N 4.5281 8.3825 118.8378 56.0249 38.5527 177.9899 109 V 3.7671 8.1892 113.9792 63.7585 31.5372 178.3213 110 L 3.8539 8.0228 120.5956 58.0495 41.8255 179.0948 111 V 3.5081 7.7655 118.1271 66.1780 31.3799 177.5703 112 C 3.9722 8.0683 116.3664 62.9379 27.9425 176.4108 113 V 3.4779 8.0268 119.9177 65.9041 31.0802 177.9182 114 L 3.8947 8.0511 118.8811 57.7230 41.3281 179.3192 115 A 3.4547 7.3942 120.8351 55.3034 18.0421 179.1674 116 H 4.0196 7.9364 115.7751 59.6792 29.9689 176.8243 117 H 4.0883 8.0015 116.9768 57.3821 29.0832 176.6557 118 F 4.6371 8.2748 117.6804 56.6461 40.2778 176.9695 119 G 3.8099 8.8294 108.6810 46.0653 0.0000 176.8516 120 K 4.2680 8.9486 120.8242 59.3012 32.1502 177.9357 121 E 4.0889 8.1282 117.4481 58.7956 30.0021 177.6334 122 F 4.5964 8.3150 123.9010 56.8965 37.9791 174.7941 123 T 4.1325 7.2768 115.2217 61.0464 71.0638 173.2868 124 P 4.1803 0.0000 0.0000 65.1932 31.2651 177.2989 125 P 4.2121 0.0000 0.0000 65.4191 31.3095 178.8411 126 V 3.5257 7.3219 115.9515 65.7479 31.3340 177.7636 127 Q 3.6806 7.7198 119.2375 59.1708 28.7467 178.3023 128 A 4.0183 8.2301 121.8205 55.1399 18.2950 179.4808 129 A 3.9193 8.0675 119.3172 55.5240 18.3853 179.5225 130 Y 3.9596 8.0993 115.2447 61.0859 38.0184 178.4519 131 Q 4.1710 8.7326 119.5034 58.4482 28.7312 178.9038 132 K 3.9804 7.8029 119.9290 59.3521 32.1616 179.2748 133 V 3.5028 7.5953 118.4240 65.9494 31.4903 178.0157 134 V 3.8591 8.1778 118.6930 65.4222 30.9833 178.2038 135 A 4.1541 8.1520 121.3400 54.5805 18.1370 179.8751 136 G 3.5554 8.1398 104.2861 47.6250 0.0000 176.2565 137 V 3.0573 7.8379 120.4412 65.5438 31.2078 178.0344 138 A 3.8995 7.6251 119.7445 55.0130 18.4821 179.1464 139 N 4.4953 8.2098 114.9313 56.4141 38.7002 177.4954 140 A 4.0087 8.1129 122.4772 55.2239 18.1716 179.7250 141 L 3.6730 7.4103 116.4052 57.2155 41.7453 178.5557 142 A 4.7248 7.7818 118.7609 52.6872 18.7391 178.3081 143 H 4.0767 8.1648 118.9921 59.5027 29.6847 177.2570 144 K 4.0427 7.9648 118.5177 58.8946 32.1165 178.5681 145 Y 4.3129 7.9949 117.9683 60.9160 37.5417 175.5089 146 H 4.5697 8.0697 120.9600 56.0804 28.8374 175.0016 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 V 8.05 4.03 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 0.96 0.00 0.00 0.92 0.00 0.00 2 H 8.83 4.05 0.00 3.20 3.30 0.00 6.08 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.86 3.81 0.00 1.74 1.65 0.79 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.36 4.30 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 1.23 0.00 0.00 5 P 0.00 4.24 0.00 2.27 2.35 0.00 3.70 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 2.07 2.03 0.00 6 E 8.10 4.00 0.00 2.17 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 0.00 2.35 2.33 0.00 7 E 8.11 3.91 0.00 2.22 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 0.00 2.29 2.28 0.00 8 K 7.88 4.04 0.00 1.75 1.75 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.40 7.81 9 S 8.28 4.04 0.00 3.96 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 10 A 8.06 3.96 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 11 V 8.20 3.38 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 0.58 0.00 0.00 0.55 0.00 0.00 12 T 8.03 4.10 4.48 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 0.00 0.00 0.00 1.26 0.00 0.00 13 A 8.00 4.06 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 14 L 7.66 3.82 0.00 2.07 1.76 0.67 -0.14 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 15 W 8.52 4.32 0.00 3.81 3.25 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 16 G 8.04 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 17 K 7.95 4.32 0.00 1.98 2.06 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.59 7.81 18 V 7.09 3.97 1.59 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 0.04 0.00 0.00 0.88 0.00 0.00 19 N 8.42 4.30 0.00 2.61 2.53 0.00 0.00 6.96 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.00 3.65 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 0.71 0.00 0.00 0.94 0.00 0.00 21 D 8.21 4.47 0.00 2.63 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 8.05 4.45 0.00 2.00 1.81 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 2.25 2.32 0.00 23 V 7.72 3.68 1.99 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 0.95 0.00 0.00 0.75 0.00 0.00 24 G 8.07 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 25 G 8.61 3.65 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 0.00 0.00 0.00 26 E 8.16 3.98 0.00 2.08 1.99 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 2.38 2.34 0.00 27 A 8.00 3.93 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 7.81 3.95 0.00 1.83 1.62 0.87 0.96 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 29 G 8.00 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 30 R 7.89 3.82 0.00 2.15 1.94 0.00 3.20 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 31 L 8.33 3.99 0.00 1.81 1.83 0.99 0.70 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 32 L 7.86 4.00 0.00 1.80 1.66 0.71 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.64 3.49 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 0.94 0.00 0.00 34 V 7.81 3.52 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 0.06 0.00 0.00 0.71 0.00 0.00 35 Y 7.52 3.88 0.00 2.53 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 4.61 0.00 2.31 2.28 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.90 0.00 37 W 8.33 4.42 0.00 3.62 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 0.00 38 T 7.71 4.40 4.45 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 1.16 0.00 0.00 39 Q 8.24 4.27 0.00 2.40 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 40 R 7.80 3.98 0.00 1.84 2.00 0.00 2.79 0.00 0.00 2.82 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.81 0.00 41 F 7.83 4.29 0.00 2.32 2.44 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 42 F 8.25 4.44 0.00 2.91 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 43 E 8.22 4.11 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 44 S 8.47 4.23 0.00 4.12 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 45 F 8.26 4.28 0.00 3.22 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 46 G 7.90 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 8.70 4.47 0.00 2.66 2.66 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 48 L 8.28 4.88 0.00 1.74 1.61 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.14 4.28 0.00 3.91 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 50 T 7.15 4.73 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 4.29 0.00 2.15 2.10 0.00 3.56 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 2.07 2.13 0.00 52 D 8.03 4.38 0.00 2.75 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 53 A 8.29 4.04 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 54 V 7.50 3.69 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 1.06 0.00 0.00 1.00 0.00 0.00 55 M 8.22 4.31 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.85 0.00 56 G 7.34 4.09 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 0.00 0.00 0.00 57 N 7.69 4.58 0.00 3.01 2.82 0.00 0.00 6.96 7.32 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 58 P 0.00 4.31 0.00 2.25 2.26 0.00 3.73 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 8.17 3.76 0.00 1.69 0.74 0.00 1.10 0.00 0.00 1.24 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.10 1.22 7.81 60 V 7.85 3.82 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.13 0.00 0.00 61 K 8.00 3.98 0.00 2.05 2.04 0.00 1.42 0.00 0.00 1.80 0.00 0.00 3.15 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.72 7.81 62 A 8.05 3.98 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 63 H 8.62 4.34 0.00 3.62 3.57 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 8.51 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 65 K 8.01 4.08 0.00 1.90 2.00 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 66 K 7.55 3.98 0.00 1.94 1.86 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.61 7.81 67 V 7.83 3.88 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 1.22 0.00 0.00 1.19 0.00 0.00 68 L 8.32 4.42 0.00 2.02 1.82 0.90 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.30 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.24 4.10 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 71 F 8.38 3.75 0.00 3.51 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 72 S 8.61 4.10 0.00 4.26 4.17 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 73 D 7.99 4.39 0.00 2.69 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 74 G 8.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.99 3.88 0.00 1.54 1.54 -0.11 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.20 4.22 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 77 H 8.13 4.95 0.00 3.15 3.19 0.00 5.85 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 8.41 4.07 0.00 1.57 1.72 0.83 1.05 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 79 D 7.93 4.58 0.00 2.74 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 80 N 8.41 5.02 0.00 2.72 2.68 0.00 0.00 7.09 6.46 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 81 L 7.89 4.13 0.00 1.68 1.81 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.35 3.95 0.00 1.97 1.76 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.53 7.81 83 G 9.23 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 7.56 3.66 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 0.43 0.00 0.00 85 F 7.97 4.47 0.00 3.10 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 86 A 7.68 3.99 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 87 T 7.79 3.92 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 1.19 0.00 0.00 88 L 7.83 4.00 0.00 2.04 1.84 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.76 4.08 0.00 3.89 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 90 E 8.13 3.92 0.00 2.20 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 0.00 2.29 2.48 0.00 91 L 8.00 3.90 0.00 1.85 1.85 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.64 4.32 0.00 3.27 3.65 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.44 4.48 0.00 2.60 1.77 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 94 D 7.75 4.19 0.00 2.82 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 7.92 4.05 0.00 1.70 1.89 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.46 7.81 96 L 7.67 4.27 0.00 1.94 1.84 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.01 4.36 0.00 3.52 3.59 0.00 5.66 0.00 0.00 0.00 0.00 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.88 3.68 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 0.36 0.00 0.00 0.54 0.00 0.00 99 D 8.48 4.18 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 3.02 0.00 2.06 2.15 0.00 3.40 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.65 0.00 101 E 8.43 3.91 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 2.27 2.38 0.00 102 N 8.22 4.44 0.00 2.78 2.86 0.00 0.00 6.94 8.31 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 0.00 103 F 7.40 4.53 0.00 3.12 2.89 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 0.00 104 R 7.99 4.02 0.00 2.10 2.01 0.00 3.15 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 105 L 7.83 3.89 0.00 1.76 1.37 0.39 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.16 4.09 0.00 1.96 1.95 0.97 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 0.00 107 G 8.35 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.38 4.53 0.00 2.96 2.94 0.00 0.00 7.03 7.29 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 0.00 109 V 8.19 3.77 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 0.97 0.00 0.00 1.08 0.00 0.00 110 L 8.02 3.85 0.00 1.85 1.71 0.31 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.77 3.51 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 1.37 0.00 0.00 1.19 0.00 0.00 112 C 8.07 3.97 0.00 3.21 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.03 3.48 2.15 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 1.10 0.00 0.00 0.89 0.00 0.00 114 L 8.05 3.89 0.00 1.10 1.33 0.46 0.55 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 0.00 115 A 7.39 3.45 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 0.00 116 H 7.94 4.02 0.00 3.17 3.26 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.00 4.09 0.00 2.89 2.55 0.00 5.68 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.27 4.64 0.00 3.22 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.83 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 0.00 120 K 8.95 4.27 0.00 1.81 1.96 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.52 7.81 121 E 8.13 4.09 0.00 2.51 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 0.00 2.43 2.37 0.00 122 F 8.31 4.60 0.00 2.99 3.19 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 0.00 0.00 0.00 123 T 7.28 4.13 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 1.31 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.13 0.00 3.59 0.00 0.00 3.77 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 4.21 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.32 3.53 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.88 0.00 0.00 127 Q 7.72 3.68 0.00 1.85 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 128 A 8.23 4.02 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 0.00 129 A 8.07 3.92 1.26 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 0.00 0.00 0.00 130 Y 8.10 3.96 0.00 3.41 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 0.00 131 Q 8.73 4.17 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.80 3.98 0.00 1.78 1.84 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.65 1.57 7.81 133 V 7.60 3.50 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 1.07 0.00 0.00 0.79 0.00 0.00 134 V 8.18 3.86 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 0.90 0.00 0.00 1.20 0.00 0.00 135 A 8.15 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 0.00 136 G 8.14 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 0.00 137 V 7.84 3.06 1.85 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 0.09 0.00 0.00 0.50 0.00 0.00 138 A 7.63 3.90 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 0.00 139 N 8.21 4.50 0.00 2.88 2.92 0.00 0.00 6.85 7.90 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 0.00 140 A 8.11 4.01 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 0.00 141 L 7.41 3.67 0.00 1.21 0.51 -0.18 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.78 4.72 1.51 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 0.00 143 H 8.16 4.08 0.00 3.29 3.42 0.00 5.78 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 0.00 144 K 7.96 4.04 0.00 1.63 1.68 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.57 7.81 145 Y 7.99 4.31 0.00 3.16 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 0.00 146 H 8.07 4.57 0.00 3.36 3.17 0.00 5.69 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