NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4587 8.2893 120.3260 54.8400 33.2805 174.3000 2 P 4.9770 0.0000 0.0000 61.2277 34.1110 171.1661 3 S 4.5854 9.0917 109.9580 59.6468 69.0024 177.1048 4 R 4.0382 6.6508 116.7168 55.8965 30.4962 177.0213 5 F 4.3231 6.6966 117.2999 60.5773 39.4906 176.0582 6 T 4.3428 7.9261 116.5025 63.7707 69.0074 174.3548 7 K 4.4458 8.5831 131.3062 56.5859 30.0742 177.9643 8 T 3.7709 7.7971 109.0984 63.2505 69.0323 173.8655 9 R 3.6185 7.9440 121.4368 57.2142 29.9796 177.9742 10 K 3.7626 9.5341 121.2547 56.9638 33.0021 171.6796 11 H 4.0908 8.3555 122.3101 56.0282 27.4754 172.7312 12 R 4.1010 8.6414 127.1173 55.3671 29.8531 177.1900 13 G 3.9202 8.4348 108.7225 46.2995 0.0000 172.1802 14 H 4.8949 7.7075 116.6630 54.9713 33.5818 173.3912 15 V 3.4841 7.3793 113.5127 61.1024 29.1492 173.9769 16 S 4.1153 7.6927 114.6826 60.5844 63.4573 176.0915 17 A 4.1161 8.0172 122.8103 54.1958 19.1035 178.0741 18 G 3.8673 7.8697 103.0857 48.1702 0.0000 173.8203 19 K 4.2933 7.8867 117.4337 57.2421 34.6106 176.8977 20 G 3.9071 7.7311 107.2592 44.8400 0.0000 171.8720 21 R 5.2764 7.2262 115.9046 56.0443 33.7902 173.3667 22 I 4.1773 9.3052 118.8443 60.6072 39.2021 173.6369 23 G 3.9506 8.1129 112.5754 45.2258 0.0000 174.8733 24 K 3.3976 8.1339 116.7663 57.8560 30.6516 174.4488 25 H 5.0677 8.6096 119.8202 55.2264 31.4510 173.6275 26 R 4.5331 8.0046 119.9463 55.6177 33.9722 171.5513 27 K 3.7085 8.6211 127.0089 56.5742 28.7962 175.0686 28 H 4.6055 7.8187 121.6491 55.6639 29.7597 173.9512 29 P 4.2324 0.0000 0.0000 64.2170 31.9784 175.5069 30 G 4.1586 9.1070 106.1559 43.1524 0.0000 173.9988 31 G 3.9268 8.3877 110.4300 46.2870 0.0000 173.0775 32 R 4.6610 7.5518 118.7059 54.2685 34.6449 176.0782 33 G 3.8362 8.7995 105.8520 47.7152 0.0000 173.5750 34 M 3.0680 9.0483 118.1939 54.7689 31.2731 177.7475 35 A 3.5143 7.5058 120.3155 51.9990 18.2652 176.6369 36 G 3.7442 8.5173 103.9872 46.3500 0.0000 174.5136 37 G 3.6114 7.0602 107.5918 46.3989 0.0000 174.0729 38 Q 4.3187 7.6564 132.9108 54.5769 29.2904 175.0330 39 H 4.6408 7.9257 132.4604 54.9250 30.4828 172.9310 40 H 4.4463 8.3942 116.7657 55.9233 29.3627 173.1676 41 H 5.1911 8.5514 116.0364 54.2504 33.2262 173.0871 42 R 4.9482 8.4306 117.7812 54.5584 33.0361 175.0672 43 I 4.2365 8.2744 124.7004 60.3297 39.7082 174.2360 44 N 5.4423 8.4036 124.7540 50.7385 42.0387 173.6408 45 M 4.7431 7.9713 121.5769 53.4253 37.0671 174.6308 46 D 4.5580 8.2823 121.7311 53.7287 41.9293 177.8136 47 K 4.1568 8.4724 121.7695 59.4012 32.6447 178.9445 48 Y 3.9519 7.9499 119.5028 60.2724 37.5648 177.6014 49 H 4.2258 7.7385 118.6793 58.7937 30.3498 175.3397 50 P 4.7287 0.0000 0.0000 65.3313 31.0293 178.9235 51 G 3.6672 8.1165 104.9560 47.9156 0.0000 175.4178 52 Y 4.1705 7.8852 118.6146 60.8374 38.3456 178.2653 53 F 5.0032 7.8723 115.9029 58.7864 38.9485 177.9144 54 G 3.9284 7.7357 106.0402 47.6466 0.0000 175.0233 55 K 4.2486 7.9898 119.1277 59.5752 33.1694 177.6518 56 V 3.9958 7.2356 113.0817 61.4389 33.2594 175.4874 57 G 4.0444 8.5532 104.3973 47.3818 0.0000 173.1402 58 M 4.3969 7.4109 123.9224 55.5656 35.6610 176.5405 59 R 3.9866 8.0185 118.3257 56.3130 30.4006 175.4848 60 Y 3.7592 8.1005 120.0833 55.4445 41.2873 175.7665 61 F 4.5484 7.4006 123.2913 57.7415 39.3760 174.0668 62 H 4.9109 8.4821 117.2252 55.5758 30.6468 175.7486 63 K 4.2504 7.4992 126.2080 56.7115 37.1599 175.6302 64 Q 4.0668 9.3155 115.9814 58.9045 28.7836 175.9319 65 Q 4.4637 7.8699 114.7891 54.8924 30.0985 175.5099 66 A 4.0577 8.2158 121.1432 52.2951 19.5208 177.2932 67 H 4.1636 8.1702 113.6904 55.8166 28.4600 173.8791 68 F 4.3602 8.1515 126.9565 57.0705 36.0021 174.8102 69 W 4.8358 7.8156 121.6172 56.3478 29.6055 176.4036 70 K 4.8237 8.6956 123.5131 53.8924 36.2374 173.9649 71 P 4.6903 0.0000 0.0000 62.5667 31.9464 176.0539 72 V 4.0673 7.9294 123.4164 60.7592 34.8608 174.6130 73 L 3.8942 8.0687 127.6316 54.3358 41.9857 177.5329 74 N 4.1992 8.1763 123.7734 56.1271 39.3017 176.6177 75 L 3.8714 7.1884 118.3540 58.2952 42.1155 178.3824 76 D 4.3975 7.5593 116.8655 56.0165 40.9018 177.7989 77 K 3.9422 7.4573 119.0614 56.2930 32.4968 176.1058 78 L 3.8464 6.8554 118.9014 52.4215 42.8422 176.2435 79 W 4.2554 7.4938 123.8354 57.8217 29.6800 175.6793 80 T 3.4328 8.6886 114.6240 63.1601 65.4737 173.0127 81 L 4.4935 8.1993 123.1903 56.8643 42.5401 178.8261 82 I 3.7646 7.7810 111.3620 63.1969 37.6065 175.3446 83 P 4.3731 0.0000 0.0000 64.1761 31.6999 176.1465 84 E 4.2041 7.8268 120.8958 55.8266 30.3678 176.6754 85 D 4.4068 8.6581 125.0724 57.0796 41.7573 176.1879 86 K 4.6574 7.8708 117.4541 55.0252 36.1736 173.9906 87 R 4.9670 8.5852 125.0061 54.6887 32.3471 174.1526 88 D 5.1301 9.2047 126.1338 52.4901 44.2974 174.6766 89 Q 4.3565 8.2560 123.1205 53.5676 30.7878 174.3044 90 Y 4.9875 7.2144 121.2118 57.3357 40.1911 178.8967 91 L 4.0203 9.1304 130.2098 55.7948 43.0025 173.5253 92 K 3.6397 8.7119 125.2857 56.9660 32.8882 176.0114 93 S 3.5130 8.6054 115.4954 58.4257 60.3688 175.5875 94 A 4.3602 7.8447 112.5983 50.7121 22.0964 176.5450 95 S 5.4437 8.9766 122.3000 57.7250 63.5364 176.1521 96 K 4.0624 7.6409 123.3780 56.8450 33.1996 174.6141 97 E 4.6237 8.6456 117.1197 55.3826 28.7088 175.3144 98 T 3.8055 8.3045 112.7704 63.9668 67.7748 175.6917 99 A 4.3635 8.4978 122.8936 52.8487 18.7479 175.4466 100 P 4.8475 0.0000 0.0000 63.4997 32.9202 174.6603 101 V 4.4636 7.6649 122.3210 63.1543 33.9180 171.1930 102 I 4.0272 8.2788 128.3152 60.0350 38.3780 174.2269 103 D 4.5526 8.0284 126.1956 53.4175 45.3366 175.0188 104 T 4.5928 7.6955 108.4262 60.5750 69.3774 174.3714 105 L 5.1222 7.4446 131.5346 57.2543 40.3691 179.0582 106 A 3.8684 9.7305 120.1014 53.9354 17.8494 176.9647 107 A 3.8268 7.5276 123.7173 52.5251 22.0098 175.5206 108 G 3.8895 7.6031 104.1836 46.8485 0.0000 172.7139 109 Y 4.6544 7.2658 116.1510 56.5925 38.9326 176.7308 110 G 4.0582 8.2977 113.2614 44.3927 0.0000 173.4071 111 K 4.4673 7.1956 123.6337 56.2254 34.4546 173.0667 112 I 4.5621 7.8465 124.1438 59.6009 41.0226 173.8663 113 L 4.4511 8.0836 124.3542 53.8370 43.1975 176.7889 114 G 3.9829 8.4115 106.1862 45.8406 0.0000 174.1701 115 K 4.5671 8.0031 117.3309 55.7487 33.1242 176.6452 116 G 4.0070 7.9311 108.4341 45.7213 0.0000 175.3130 117 R 4.0672 7.9284 116.3787 58.9903 30.2214 178.8607 118 I 3.8649 7.7870 118.2553 63.1110 37.1682 175.2397 119 P 4.4754 0.0000 0.0000 62.8713 32.0467 175.2404 120 N 4.2157 7.6079 117.5675 53.7262 38.8088 174.2714 121 V 3.2071 8.0278 124.1940 61.6788 31.9980 173.4596 122 P 4.0771 0.0000 0.0000 63.2260 31.5917 175.5337 123 V 4.4116 7.9440 114.1565 60.0528 35.7552 175.1302 124 I 4.1293 8.0335 121.2469 59.5265 36.9670 173.4050 125 V 4.2373 8.0165 126.2773 61.5313 32.0209 174.6751 126 K 4.7346 8.8301 128.2874 54.5451 35.5198 174.4851 127 A 4.9903 8.5298 127.2426 50.2211 22.4588 175.5746 128 R 4.0496 8.2377 120.2319 55.0884 32.4044 177.6532 129 F 4.1399 8.5339 119.4613 60.5470 38.6187 178.2984 130 V 3.7967 7.8798 117.1666 64.8620 31.2409 177.8766 131 S 4.2264 7.5182 112.1760 61.0594 62.4793 176.0380 132 K 4.0071 7.6181 120.2255 58.1863 31.6550 178.6417 133 L 3.9616 8.2075 118.8389 54.8914 41.8714 174.2830 134 A 4.5577 7.4019 118.1077 51.4624 19.2369 176.4034 135 E 4.0906 8.0482 118.5256 56.5137 30.2183 175.7354 136 E 4.7675 8.7641 125.4838 54.5727 31.8340 176.2881 137 K 4.5753 8.2645 124.8511 55.5902 32.8463 176.7563 138 I 3.5088 8.0086 119.3495 63.1235 38.5982 175.5946 139 R 3.3974 9.0717 130.1163 57.3833 30.1384 174.7675 140 A 3.4739 8.5973 117.1477 53.0756 17.4067 175.9805 141 A 4.4488 8.3754 115.6126 52.3104 22.2406 176.4636 142 G 3.6590 9.0671 110.8291 46.0643 0.0000 173.6116 143 G 3.0983 7.6718 112.8167 44.3132 0.0000 173.1756 144 V 4.2484 7.5709 118.6620 60.8578 34.3445 174.5481 145 V 3.7044 8.3803 127.0841 63.0019 31.9483 175.1481 146 E 4.1963 8.6233 126.1099 56.2207 29.9781 176.2685 147 L 4.9204 8.0582 122.3013 53.2185 45.5345 175.6681 148 I 4.3131 7.8393 118.0518 60.0704 40.8745 174.2773 149 A 4.2290 8.5963 128.9034 52.4916 18.5307 177.1092 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 8.29 4.46 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 2 P 0.00 4.98 0.00 2.15 1.96 0.00 3.35 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 3 S 9.09 4.59 0.00 4.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 6.65 4.04 0.00 1.54 1.86 0.00 3.33 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.44 0.00 5 F 6.70 4.32 0.00 3.13 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 6 T 7.93 4.34 4.40 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 1.28 0.00 0.00 7 K 8.58 4.45 0.00 1.85 2.11 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.29 1.54 7.81 8 T 7.80 3.77 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 1.11 0.00 0.00 9 R 7.94 3.62 0.00 1.90 1.95 0.00 3.27 0.00 0.00 3.39 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 10 K 9.53 3.76 0.00 2.05 2.04 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.68 7.81 11 H 8.36 4.09 0.00 3.32 3.53 0.00 5.77 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.64 4.10 0.00 2.02 2.01 0.00 3.23 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 13 G 8.43 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 14 H 7.71 4.89 0.00 3.11 3.12 0.00 5.79 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 7.38 3.48 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.91 0.00 0.00 16 S 7.69 4.12 0.00 4.01 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 17 A 8.02 4.12 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 18 G 7.87 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 19 K 7.89 4.29 0.00 1.81 1.87 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.26 1.60 7.81 20 G 7.73 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 21 R 7.23 5.28 0.00 1.76 1.80 0.00 3.32 0.00 0.00 3.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 22 I 9.31 4.18 1.87 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 1.34 0.54 0.91 0.00 0.00 23 G 8.11 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 24 K 8.13 3.40 0.00 1.88 1.68 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 25 H 8.61 5.07 0.00 3.16 3.21 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.00 4.53 0.00 1.75 1.77 0.00 3.29 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 27 K 8.62 3.71 0.00 1.93 1.93 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.43 7.81 28 H 7.82 4.61 0.00 3.15 3.14 0.00 5.73 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.23 0.00 2.18 2.10 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 30 G 9.11 4.16 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 0.00 0.00 0.00 31 G 8.39 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 0.00 0.00 0.00 32 R 7.55 4.66 0.00 1.76 1.78 0.00 3.34 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 33 G 8.80 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 9.05 3.07 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 35 A 7.51 3.51 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 36 G 8.52 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 37 G 7.06 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 38 Q 7.66 4.32 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 39 H 7.93 4.64 0.00 2.93 2.73 0.00 5.98 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.39 4.45 0.00 2.72 2.94 0.00 5.69 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.55 5.19 0.00 2.99 3.16 0.00 5.56 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.43 4.95 0.00 1.67 2.00 0.00 3.22 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 43 I 8.27 4.24 1.91 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 1.20 0.94 0.87 0.00 0.00 44 N 8.40 5.44 0.00 2.60 2.44 0.00 0.00 7.04 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 45 M 7.97 4.74 0.00 1.65 1.70 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 46 D 8.28 4.56 0.00 1.69 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.47 4.16 0.00 2.05 2.23 0.00 1.49 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.50 7.81 48 Y 7.95 3.95 0.00 2.43 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.74 4.23 0.00 3.13 3.48 0.00 5.76 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 50 P 0.00 4.73 0.00 2.26 2.16 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 51 G 8.12 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 52 Y 7.89 4.17 0.00 2.60 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 53 F 7.87 5.00 0.00 3.36 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 54 G 7.74 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 0.00 0.00 0.00 55 K 7.99 4.25 0.00 1.78 1.62 0.00 1.39 0.00 0.00 1.50 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.48 7.81 56 V 7.24 4.00 2.14 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 0.75 0.00 0.00 1.17 0.00 0.00 57 G 8.55 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 58 M 7.41 4.40 0.00 2.11 2.43 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 59 R 8.02 3.99 0.00 1.76 1.87 0.00 3.07 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 60 Y 8.10 3.76 0.00 2.95 2.83 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 0.00 0.00 0.00 61 F 7.40 4.55 0.00 3.06 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 62 H 8.48 4.91 0.00 3.29 3.39 0.00 5.58 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.50 4.25 0.00 1.70 0.95 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 1.40 7.81 64 Q 9.32 4.07 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 65 Q 7.87 4.46 0.00 2.27 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 66 A 8.22 4.06 0.39 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 67 H 8.17 4.16 0.00 2.81 2.85 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 8.15 4.36 0.00 3.17 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 69 W 7.82 4.84 0.00 3.37 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 70 K 8.70 4.82 0.00 1.79 1.76 0.00 2.01 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.61 1.67 7.81 71 P 0.00 4.69 0.00 1.91 1.95 0.00 3.90 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 72 V 7.93 4.07 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 0.58 0.00 0.00 0.98 0.00 0.00 73 L 8.07 3.89 0.00 1.73 1.39 0.71 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.18 4.20 0.00 2.64 2.84 0.00 0.00 6.39 7.27 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 75 L 7.19 3.87 0.00 1.73 1.75 0.90 1.17 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 76 D 7.56 4.40 0.00 2.47 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.46 3.94 0.00 1.63 1.93 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.34 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.34 7.81 78 L 6.86 3.85 0.00 1.47 1.40 0.78 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 79 W 7.49 4.26 0.00 3.52 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 80 T 8.69 3.43 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 1.23 0.00 0.00 81 L 8.20 4.49 0.00 1.71 1.63 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.78 3.76 1.95 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 1.48 0.60 0.96 0.00 0.00 83 P 0.00 4.37 0.00 2.19 2.23 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.95 0.00 84 E 7.83 4.20 0.00 2.01 2.12 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 2.41 2.48 0.00 85 D 8.66 4.41 0.00 2.78 2.78 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 86 K 7.87 4.66 0.00 1.84 1.57 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.45 7.81 87 R 8.59 4.97 0.00 1.98 1.72 0.00 3.11 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 88 D 9.20 5.13 0.00 2.51 2.41 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 89 Q 8.26 4.36 0.00 1.67 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.69 0.00 0.00 0.00 0.00 0.00 1.67 2.08 0.00 90 Y 7.21 4.99 0.00 2.79 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 0.00 0.00 0.00 0.00 91 L 9.13 4.02 0.00 1.57 1.58 0.96 0.61 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 92 K 8.71 3.64 0.00 1.88 1.71 0.00 1.81 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 1.34 1.40 7.81 93 S 8.61 3.51 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 94 A 7.84 4.36 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 0.00 0.00 0.00 0.00 0.00 95 S 8.98 5.44 0.00 4.08 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 96 K 7.64 4.06 0.00 1.88 1.76 0.00 1.51 0.00 0.00 1.81 0.00 0.00 3.24 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.58 7.81 97 E 8.65 4.62 0.00 2.00 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 2.13 2.16 0.00 98 T 8.30 3.81 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 1.20 0.00 0.00 99 A 8.50 4.36 1.42 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 0.00 0.00 100 P 0.00 4.85 0.00 2.14 2.00 0.00 3.93 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 101 V 7.66 4.46 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 0.61 0.00 0.00 0.84 0.00 0.00 102 I 8.28 4.03 1.87 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 1.12 0.55 1.11 0.00 0.00 103 D 8.03 4.55 0.00 2.61 2.52 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 0.00 104 T 7.70 4.59 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 0.70 0.00 0.00 105 L 7.44 5.12 0.00 1.79 1.58 1.02 0.74 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 0.00 106 A 9.73 3.87 1.63 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 0.00 107 A 7.53 3.83 1.02 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 0.00 108 G 7.60 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 0.00 109 Y 7.27 4.65 0.00 3.18 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 0.00 110 G 8.30 4.06 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 0.00 0.00 0.00 111 K 7.20 4.47 0.00 1.87 1.71 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.26 1.23 7.81 112 I 7.85 4.56 1.42 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.58 0.81 0.00 0.00 113 L 8.08 4.45 0.00 1.75 1.64 0.99 0.94 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 0.00 114 G 8.41 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 0.00 0.00 0.00 115 K 8.00 4.57 0.00 1.68 1.75 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.36 7.81 116 G 7.93 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 0.00 0.00 0.00 117 R 7.93 4.07 0.00 1.97 2.13 0.00 2.94 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.61 0.00 118 I 7.79 3.86 1.84 0.00 0.00 0.84 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 0.56 0.89 0.00 0.00 119 P 0.00 4.48 0.00 2.00 2.06 0.00 3.67 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 120 N 7.61 4.22 0.00 2.82 2.87 0.00 0.00 7.08 7.59 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 0.00 121 V 8.03 3.21 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 0.55 0.00 0.00 0.77 0.00 0.00 122 P 0.00 4.08 0.00 2.02 1.98 0.00 3.57 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 123 V 7.94 4.41 2.09 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 0.76 0.00 0.00 0.99 0.00 0.00 124 I 8.03 4.13 1.88 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 1.29 0.84 0.92 0.00 0.00 125 V 8.02 4.24 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 0.85 0.00 0.00 0.95 0.00 0.00 126 K 8.83 4.73 0.00 1.82 1.47 0.00 1.52 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.27 1.34 7.81 127 A 8.53 4.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 R 8.24 4.05 0.00 2.08 1.80 0.00 3.12 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 129 F 8.53 4.14 0.00 3.27 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 0.00 130 V 7.88 3.80 2.14 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 0.79 0.00 0.00 0.96 0.00 0.00 131 S 7.52 4.23 0.00 4.00 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 0.00 132 K 7.62 4.01 0.00 1.96 1.84 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.56 7.81 133 L 8.21 3.96 0.00 1.80 1.89 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.40 4.56 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 0.00 135 E 8.05 4.09 0.00 2.11 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 2.53 2.47 0.00 136 E 8.76 4.77 0.00 1.98 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 137 K 8.26 4.58 0.00 1.75 1.75 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.38 7.81 138 I 8.01 3.51 1.87 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 1.30 0.81 0.91 0.00 0.00 139 R 9.07 3.40 0.00 1.93 1.83 0.00 3.43 0.00 0.00 3.22 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 140 A 8.60 3.47 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 0.00 141 A 8.38 4.45 1.16 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 0.00 0.00 142 G 9.07 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 0.00 143 G 7.67 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 0.00 0.00 0.00 144 V 7.57 4.25 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 0.74 0.00 0.00 0.85 0.00 0.00 145 V 8.38 3.70 2.09 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 0.86 0.00 0.00 0.96 0.00 0.00 146 E 8.62 4.20 0.00 1.97 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 2.31 2.39 0.00 147 L 8.06 4.92 0.00 1.56 1.52 0.95 0.79 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 0.00 148 I 7.84 4.31 1.88 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 1.36 0.51 0.93 0.00 0.00 149 A 8.60 4.23 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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