NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4713 8.1633 120.6128 55.4288 33.7688 173.3563 2 K 4.8961 8.3902 126.2683 54.8438 34.1173 174.2060 3 I 4.8729 8.6594 126.3577 59.4004 40.3475 174.0265 4 L 4.5228 8.3730 129.7009 53.8683 43.5306 175.1706 5 V 4.7759 8.7428 127.3769 61.5252 33.4828 174.1658 6 I 5.0688 8.8238 129.7890 59.7792 39.6979 174.6777 7 Q 4.8066 9.4886 126.7658 54.2353 31.1534 176.5310 8 G 4.1231 8.7820 115.3775 43.6988 0.0000 170.9902 9 P 4.3899 0.0000 0.0000 64.3057 31.6070 177.2903 10 N 4.4476 9.0787 116.7148 53.7927 38.0658 176.6360 11 L 3.9389 7.3997 118.2420 57.2221 41.8041 178.8457 12 N 4.3787 7.9713 114.7546 55.2003 35.9448 175.4045 13 M 4.2980 7.8901 118.1114 55.2016 32.5551 176.0716 14 L 3.9533 7.3957 120.5724 56.2514 42.5617 178.0958 15 G 4.3027 8.9323 114.6569 44.5116 0.0000 175.3551 16 H 4.1346 7.2414 115.1414 58.4573 28.7284 176.3323 17 R 4.3539 7.9863 114.8681 55.2734 30.6302 175.4840 18 D 4.5986 8.2222 117.9770 53.7608 39.0444 173.4503 19 P 4.6171 0.0000 0.0000 63.6206 28.8954 176.4776 20 R 4.1013 9.0241 122.7604 57.4212 30.6964 177.7800 21 L 4.0238 7.9174 118.0596 57.7517 41.9829 178.1643 22 Y 4.2685 7.8480 113.6945 57.9918 39.4676 174.3196 23 G 3.9563 7.2633 103.5120 44.5178 0.0000 173.5448 24 M 4.5415 8.5176 116.8191 55.2889 33.9632 176.2299 25 V 4.0281 7.6027 118.9666 62.2697 32.6097 176.2364 26 T 4.4456 8.0133 118.8165 60.0558 71.2029 175.7544 27 L 3.6769 8.0455 122.3089 58.2289 41.9830 178.5587 28 D 4.1556 7.8238 118.3251 57.4829 40.7507 178.6217 29 Q 4.1000 7.7363 118.2671 58.9151 28.6267 178.9872 30 I 3.5640 7.5882 120.8602 64.7428 37.1062 178.2632 31 H 3.8959 7.7907 116.8962 58.4847 28.1955 177.8630 32 E 3.9376 8.4201 120.9750 59.5225 29.3576 179.1055 33 I 3.7634 7.9045 119.9488 64.8552 37.1036 178.4128 34 M 4.4277 7.9362 120.5637 58.0136 31.8007 178.6053 35 Q 4.1088 8.1930 118.1526 59.4548 28.9261 178.9564 36 T 3.9167 8.2944 116.9643 67.0112 68.3173 176.1802 37 F 4.1041 8.3920 122.1166 61.3106 39.4625 177.3480 38 V 3.6965 7.9596 117.9427 65.8184 31.3280 178.2442 39 K 3.9665 8.4024 118.5146 59.5814 31.8815 179.1758 40 Q 4.2549 8.2114 115.4992 57.2678 28.7505 177.2699 41 G 3.7968 6.9145 106.6186 43.8810 0.0000 172.7768 42 N 4.2146 8.7476 115.7896 53.8843 36.7794 174.5190 43 L 4.0999 7.5230 117.1219 55.1325 42.5850 177.7274 44 D 4.6510 8.3127 123.1793 52.8262 39.6899 175.6452 45 V 4.7174 7.2779 118.6816 61.2233 35.2405 174.4458 46 E 4.6470 8.9983 127.6233 54.8049 31.3943 175.0087 47 L 4.7446 8.4065 124.6607 53.5313 43.3754 175.4810 48 E 4.5029 8.6705 124.0904 54.4050 31.9265 174.4218 49 F 5.4229 8.6328 125.1157 56.0372 41.4871 175.0744 50 F 5.0709 9.4631 124.7179 56.9178 42.9024 172.7223 51 Q 4.9146 8.1030 126.5182 54.6479 31.5315 173.9787 52 T 4.5776 8.3870 118.8222 61.3579 70.7479 172.9965 53 N 4.7591 9.0906 121.0817 53.1340 39.7746 175.2679 54 F 4.8133 8.6845 119.6473 55.5726 40.9937 175.6993 55 E 3.7756 9.0133 124.6968 59.6031 29.2290 179.2740 56 G 3.6839 8.1747 104.8616 47.7667 0.0000 175.4128 57 E 4.0964 8.3704 120.4393 59.2315 29.5849 179.0696 58 I 3.9132 7.9428 119.7232 64.6098 37.1640 178.5328 59 I 3.7108 7.7932 120.3592 64.4331 36.8957 177.8994 60 D 4.3762 8.3605 120.1557 57.5281 40.8507 179.2131 61 K 3.7800 8.1876 119.6725 59.5118 31.9802 178.7104 62 I 3.6906 7.6480 118.9031 64.6486 37.2770 178.1250 63 Q 4.1456 8.3105 118.8237 59.0415 28.3898 178.5889 64 E 4.0731 8.3696 118.5640 58.6547 29.2178 178.9962 65 S 4.5501 7.9207 114.0170 60.7925 62.9303 176.3347 66 V 3.7246 7.7498 122.3068 66.0407 31.4445 177.9430 67 G 3.7790 8.0435 104.9705 47.2084 0.0000 173.1734 68 S 4.5897 7.4920 114.2610 57.2703 64.9964 172.9298 69 D 4.7274 8.0500 117.5985 53.8787 39.7370 175.7854 70 Y 4.7491 7.2835 117.4234 58.4102 38.8877 175.8680 71 E 4.3333 9.2965 125.5021 58.7929 30.6651 176.7527 72 G 4.2208 7.7287 103.8292 45.4893 0.0000 172.2437 73 I 5.1409 8.8215 121.2743 59.2982 40.8107 174.7284 74 I 4.8944 8.7123 127.4099 59.5946 39.6456 174.5594 75 I 5.0384 9.1085 127.0304 59.3154 41.8136 173.3198 76 N 5.2840 9.1296 127.8463 50.4843 40.3035 172.8862 77 P 4.5399 0.0000 0.0000 62.3041 32.9264 178.1181 78 G 3.7762 8.8180 108.5682 45.9838 0.0000 175.6840 79 A 4.2543 8.3167 121.7719 54.9044 18.7161 179.4778 80 F 4.7941 7.6352 114.6782 60.0009 38.9014 177.5779 81 S 4.5188 8.3140 117.3783 61.2394 62.4079 175.9421 82 H 4.8505 8.0098 117.8088 56.3745 28.8356 176.1403 83 T 4.6871 7.9908 108.4495 61.5676 71.0094 174.5897 84 S 4.4260 8.5017 117.6205 56.7660 61.6013 174.0790 85 I 3.4221 7.7212 129.4471 63.6171 37.0468 177.4687 86 A 3.9256 7.8594 121.1687 55.4858 18.1481 179.6507 87 I 3.6835 8.0491 118.1960 64.2656 37.1310 178.4717 88 A 4.0404 7.8571 121.4696 55.3162 18.2136 179.3968 89 D 4.2686 8.5630 117.4447 57.4934 40.7043 178.7067 90 A 3.9992 7.7845 119.8346 55.4709 18.5731 179.4363 91 I 3.8274 8.1825 118.4748 64.8682 36.9603 178.6587 92 M 4.1954 8.0745 118.7056 57.3931 31.7134 177.6769 93 L 4.4829 7.6913 118.0517 55.8235 40.8471 178.0964 94 A 3.9455 7.8350 122.0733 52.9833 18.7770 177.6662 95 G 4.0372 7.5042 105.7244 45.5017 0.0000 172.8520 96 K 4.4204 7.4425 113.5397 54.6521 35.2654 173.1425 97 P 4.3873 0.0000 0.0000 62.9436 32.5865 175.4227 98 V 4.8878 8.4907 123.6584 61.0959 34.7425 173.8274 99 I 4.8938 8.7977 128.6645 59.5023 40.0235 173.9814 100 E 5.0010 8.8947 128.1951 54.7915 31.1577 174.7003 101 V 4.7854 8.6678 126.6080 61.3318 34.9358 173.8031 102 H 5.0101 9.2016 123.4879 54.0246 32.2065 173.9837 103 L 4.1673 9.1190 123.7984 58.0116 42.1508 177.7651 104 T 4.4028 7.7195 106.4817 60.0124 70.5816 174.6146 105 N 4.4574 8.1378 121.4697 52.6627 37.3556 175.4310 106 I 3.9002 7.8895 118.0052 62.4985 38.0780 177.9278 107 Q 3.9405 7.9138 120.1504 58.3680 28.5735 176.8126 108 A 4.5783 8.0510 119.3585 51.7492 19.3552 176.5531 109 R 4.7760 7.2451 119.0686 55.6055 33.1688 175.3757 110 E 3.7751 8.2792 117.1991 57.2174 30.2297 177.6674 111 E 3.7937 8.6950 122.1294 59.3939 29.6553 178.9641 112 F 4.4586 7.6893 110.9074 58.5331 37.9606 175.5197 113 R 3.8894 7.1065 119.2211 56.0734 31.0254 177.5759 114 K 4.1392 7.8230 118.0030 59.0896 31.9199 177.6292 115 N 4.1949 7.9350 117.5154 53.5293 39.5706 173.4612 116 S 4.6540 8.2359 118.1652 55.8263 64.6822 173.9388 117 Y 4.2448 8.3997 127.9372 61.4356 38.1438 178.5103 118 T 4.2021 8.2229 110.2699 65.0184 68.7058 176.4791 119 G 3.6616 8.3368 108.3681 47.2626 0.0000 175.5356 120 A 4.0556 7.8472 121.4932 54.5647 18.4603 178.9575 121 A 4.2274 7.6989 117.6676 53.3037 19.0097 177.6485 122 C 4.4595 6.9970 115.0083 58.9158 29.2205 174.1054 123 G 3.7829 8.3771 109.0090 49.4490 0.0000 173.9076 124 G 4.4081 7.7236 105.2356 45.1309 0.0000 172.2340 125 V 5.1443 8.2018 119.0610 61.0412 35.0904 174.4745 126 I 4.8753 9.0119 127.8195 59.7041 40.4074 174.3454 127 M 5.0647 8.8135 123.5130 54.4875 34.2809 175.2788 128 G 3.6734 9.1063 109.3332 45.9533 0.0000 173.7282 129 F 4.7107 8.0549 114.7734 56.0282 40.1409 177.6828 130 G 3.9636 8.0494 111.1256 45.1798 0.0000 172.9306 131 P 4.5397 0.0000 0.0000 65.5995 31.8693 178.0849 132 L 4.0208 8.3191 119.4894 58.2191 41.7238 178.8814 133 G 3.7259 8.2832 105.6086 48.2761 0.0000 175.1718 134 Y 4.0674 8.2388 118.7745 60.9492 37.3162 178.3634 135 N 3.9394 8.0327 117.0334 56.1988 38.5609 177.1683 136 M 3.8764 7.8346 120.0171 58.1661 31.8812 178.6899 137 A 3.9088 7.8339 120.8696 54.9598 18.5093 179.5283 138 L 3.9282 7.9513 117.6012 58.1915 41.7636 179.1500 139 M 4.0978 8.4283 118.0223 59.0049 32.0572 178.1631 140 A 3.9961 8.1592 120.6720 55.1652 18.4697 179.2041 141 M 3.9414 8.4032 117.1245 58.9181 32.2923 178.4948 142 V 3.6451 7.9925 118.4012 66.3449 31.6469 177.7675 143 N 4.3872 8.2467 116.0582 56.1651 38.3900 177.6266 144 I 3.7537 8.0960 121.8165 64.1936 37.1946 178.5217 145 L 3.9419 8.4264 120.0296 57.7916 41.5580 179.0103 146 A 3.9987 8.1654 121.0200 55.6465 17.7063 179.2789 147 E 4.0643 8.2575 117.0330 59.1643 29.8656 178.7963 148 M 4.1928 7.9716 119.1215 58.1459 31.8040 178.5253 149 K 4.2295 8.0426 117.2171 58.3854 32.3054 178.8811 150 A 4.1667 8.0711 121.4654 55.2733 18.1359 179.2914 151 F 4.2856 7.7700 116.6473 61.5727 39.4741 176.4591 152 Q 3.8551 7.4583 116.6756 59.6774 28.8711 177.3188 153 E 4.2024 7.6844 121.3496 56.7144 29.6645 176.8198 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.47 0.00 2.45 2.07 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 2 K 8.39 4.90 0.00 2.01 1.91 0.00 1.18 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.46 1.45 7.81 3 I 8.66 4.87 1.86 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.13 0.91 0.00 0.00 4 L 8.37 4.52 0.00 0.75 1.16 0.68 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.74 4.78 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.99 0.00 0.00 6 I 8.82 5.07 1.98 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 1.41 0.58 1.10 0.00 0.00 7 Q 9.49 4.81 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 8 G 8.78 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.39 0.00 1.85 1.81 0.00 3.61 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.44 0.00 10 N 9.08 4.45 0.00 2.79 2.85 0.00 0.00 6.95 6.61 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 11 L 7.40 3.94 0.00 1.73 1.65 1.06 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 12 N 7.97 4.38 0.00 2.78 2.99 0.00 0.00 6.04 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.89 4.30 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.57 0.00 14 L 7.40 3.95 0.00 1.70 1.73 0.89 1.00 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 15 G 8.93 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 7.24 4.13 0.00 3.16 3.36 0.00 5.66 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 17 R 7.99 4.35 0.00 1.79 1.96 0.00 3.53 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 18 D 8.22 4.60 0.00 2.92 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 19 P 0.00 4.62 0.00 2.12 2.13 0.00 3.82 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 20 R 9.02 4.10 0.00 1.91 1.97 0.00 3.13 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 21 L 7.92 4.02 0.00 1.21 1.39 1.23 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.85 4.27 0.00 2.91 3.02 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 23 G 7.26 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 24 M 8.52 4.54 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 25 V 7.60 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 0.82 0.00 0.00 0.94 0.00 0.00 26 T 8.01 4.45 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 1.06 0.00 0.00 27 L 8.05 3.68 0.00 1.74 1.52 0.71 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.82 4.16 0.00 2.64 2.61 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 29 Q 7.74 4.10 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 30 I 7.59 3.56 1.61 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.63 0.37 0.00 0.00 31 H 7.79 3.90 0.00 2.72 1.62 0.00 5.64 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 32 E 8.42 3.94 0.00 2.09 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 2.32 2.30 0.00 33 I 7.90 3.76 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.01 1.01 0.00 0.00 34 M 7.94 4.43 0.00 2.30 2.51 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.54 0.00 35 Q 8.19 4.11 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.84 2.70 0.00 36 T 8.29 3.92 4.51 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 1.27 0.00 0.00 37 F 8.39 4.10 0.00 3.31 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 38 V 7.96 3.70 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 1.12 0.00 0.00 1.14 0.00 0.00 39 K 8.40 3.97 0.00 1.83 1.83 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.51 7.81 40 Q 8.21 4.25 0.00 1.83 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.71 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 41 G 6.91 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 0.00 0.00 0.00 42 N 8.75 4.21 0.00 2.79 2.88 0.00 0.00 6.96 8.16 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 43 L 7.52 4.10 0.00 1.71 1.64 0.96 0.77 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 44 D 8.31 4.65 0.00 2.61 2.61 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 45 V 7.28 4.72 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 0.91 0.00 0.00 0.97 0.00 0.00 46 E 9.00 4.65 0.00 1.96 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 2.24 2.26 0.00 47 L 8.41 4.74 0.00 0.92 0.74 1.06 0.86 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 48 E 8.67 4.50 0.00 2.16 1.75 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 2.25 2.34 0.00 49 F 8.63 5.42 0.00 2.94 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 50 F 9.46 5.07 0.00 3.05 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 51 Q 8.10 4.91 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.53 0.00 0.00 0.00 0.00 0.00 2.29 2.16 0.00 52 T 8.39 4.58 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 1.37 0.00 0.00 53 N 9.09 4.76 0.00 2.63 2.66 0.00 0.00 6.87 7.45 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 54 F 8.68 4.81 0.00 3.14 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 55 E 9.01 3.78 0.00 1.18 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 0.00 2.13 1.71 0.00 56 G 8.17 3.68 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 0.00 0.00 0.00 57 E 8.37 4.10 0.00 2.36 2.40 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 2.61 2.41 0.00 58 I 7.94 3.91 2.16 0.00 0.00 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 1.73 0.99 1.04 0.00 0.00 59 I 7.79 3.71 1.88 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 1.52 0.77 0.91 0.00 0.00 60 D 8.36 4.38 0.00 2.96 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 61 K 8.19 3.78 0.00 1.92 1.74 0.00 1.39 0.00 0.00 0.82 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 1.22 7.81 62 I 7.65 3.69 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.83 0.95 0.00 0.00 63 Q 8.31 4.15 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 64 E 8.37 4.07 0.00 1.99 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 2.32 2.37 0.00 65 S 7.92 4.55 0.00 4.07 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 0.00 66 V 7.75 3.72 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 67 G 8.04 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 68 S 7.49 4.59 0.00 3.87 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 69 D 8.05 4.73 0.00 2.70 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 70 Y 7.28 4.75 0.00 3.21 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 71 E 9.30 4.33 0.00 1.88 2.04 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 0.00 2.35 2.44 0.00 72 G 7.73 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 0.00 0.00 0.00 0.00 73 I 8.82 5.14 1.87 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 1.11 0.80 0.97 0.00 0.00 74 I 8.71 4.89 1.96 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 1.14 0.80 1.03 0.00 0.00 75 I 9.11 5.04 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.92 0.94 0.00 0.00 76 N 9.13 5.28 0.00 2.87 3.00 0.00 0.00 7.10 7.55 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 77 P 0.00 4.54 0.00 2.42 2.21 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.15 0.00 78 G 8.82 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 79 A 8.32 4.25 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 80 F 7.64 4.79 0.00 3.25 3.04 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 0.00 0.00 0.00 0.00 81 S 8.31 4.52 0.00 3.57 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 82 H 8.01 4.85 0.00 3.30 3.53 0.00 5.55 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 7.99 4.69 4.37 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 1.37 0.00 0.00 84 S 8.50 4.43 0.00 3.79 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 85 I 7.72 3.42 1.65 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 -0.36 0.74 0.00 0.00 86 A 7.86 3.93 1.24 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 0.00 0.00 0.00 87 I 8.05 3.68 1.91 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 1.47 0.61 0.98 0.00 0.00 88 A 7.86 4.04 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 89 D 8.56 4.27 0.00 2.79 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 90 A 7.78 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.18 3.83 2.05 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 1.55 1.36 0.97 0.00 0.00 92 M 8.07 4.20 0.00 2.01 2.22 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 2.66 2.56 0.00 93 L 7.69 4.48 0.00 1.93 1.89 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.84 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.50 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.44 4.42 0.00 2.03 1.77 0.00 1.63 0.00 0.00 1.90 0.00 0.00 3.25 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.43 7.81 97 P 0.00 4.39 0.00 2.11 2.04 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 98 V 8.49 4.89 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 1.09 0.00 0.00 1.01 0.00 0.00 99 I 8.80 4.89 1.86 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 1.11 0.51 0.88 0.00 0.00 100 E 8.89 5.00 0.00 2.06 1.80 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 2.09 2.31 0.00 101 V 8.67 4.79 1.49 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 0.05 0.00 0.00 0.64 0.00 0.00 102 H 9.20 5.01 0.00 3.07 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 9.12 4.17 0.00 1.77 1.84 1.14 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.72 4.40 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 0.76 0.00 0.00 105 N 8.14 4.46 0.00 2.57 2.64 0.00 0.00 6.65 7.99 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 0.00 106 I 7.89 3.90 1.98 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.61 0.79 0.00 0.00 107 Q 7.91 3.94 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.36 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 108 A 8.05 4.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.25 4.78 0.00 1.59 1.68 0.00 3.06 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.60 0.00 110 E 8.28 3.78 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 111 E 8.69 3.79 0.00 1.98 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 2.36 0.00 112 F 7.69 4.46 0.00 3.09 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 0.00 113 R 7.11 3.89 0.00 1.63 1.75 0.00 3.08 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.15 0.00 114 K 7.82 4.14 0.00 1.78 1.79 0.00 1.74 0.00 0.00 1.56 0.00 0.00 3.13 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.50 1.42 7.81 115 N 7.93 4.19 0.00 2.67 2.57 0.00 0.00 6.56 7.63 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 0.00 116 S 8.24 4.65 0.00 3.89 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 0.00 117 Y 8.40 4.24 0.00 3.23 2.98 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 0.00 118 T 8.22 4.20 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 1.33 0.00 0.00 119 G 8.34 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 0.00 0.00 0.00 120 A 7.85 4.06 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.70 4.23 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 C 7.00 4.46 0.00 3.09 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 G 8.38 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 0.00 124 G 7.72 4.41 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 0.00 125 V 8.20 5.14 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 0.95 0.00 0.00 0.95 0.00 0.00 126 I 9.01 4.88 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.51 1.02 0.00 0.00 127 M 8.81 5.06 0.00 2.00 2.11 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 2.37 2.52 0.00 128 G 9.11 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.05 4.71 0.00 2.98 2.98 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 0.00 130 G 8.05 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 0.00 131 P 0.00 4.54 0.00 2.24 2.16 0.00 3.69 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 2.15 2.14 0.00 132 L 8.32 4.02 0.00 1.79 2.00 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 133 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 0.00 134 Y 8.24 4.07 0.00 3.22 3.04 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 0.00 0.00 0.00 0.00 135 N 8.03 3.94 0.00 2.50 1.59 0.00 0.00 7.15 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 M 7.83 3.88 0.00 1.83 2.04 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.26 0.00 137 A 7.83 3.91 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 0.00 138 L 7.95 3.93 0.00 1.73 1.85 1.06 0.74 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 0.00 139 M 8.43 4.10 0.00 2.13 2.24 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 2.68 2.61 0.00 140 A 8.16 4.00 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 0.00 141 M 8.40 3.94 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 142 V 7.99 3.65 2.38 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 1.10 0.00 0.00 1.00 0.00 0.00 143 N 8.25 4.39 0.00 2.95 2.86 0.00 0.00 7.05 7.39 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 0.00 144 I 8.10 3.75 2.05 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 1.53 0.98 0.92 0.00 0.00 145 L 8.43 3.94 0.00 1.68 1.74 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.17 4.00 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 0.00 147 E 8.26 4.06 0.00 2.28 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 148 M 7.97 4.19 0.00 2.18 2.33 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 2.74 2.62 0.00 149 K 8.04 4.23 0.00 1.77 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.64 7.81 150 A 8.07 4.17 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 0.00 151 F 7.77 4.29 0.00 3.05 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 0.00 152 Q 7.46 3.86 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 153 E 7.68 4.20 0.00 2.13 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 2.33 2.31 0.00