NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3754 8.3044 120.3251 55.7229 32.8697 174.9479 2 H 4.5168 7.9939 125.6447 53.7858 29.0481 172.2154 3 L 4.5307 7.1937 120.4322 53.4268 43.8388 177.6511 4 T 4.0403 8.9604 115.5592 60.5807 70.8883 173.5248 5 P 4.1780 0.0000 0.0000 66.0771 30.8986 178.8167 6 E 4.0093 8.0968 115.3370 59.2182 29.4748 178.8242 7 E 3.9627 7.6867 119.0299 58.9793 29.4618 178.9574 8 K 3.9003 8.2888 120.3047 59.2741 32.1536 179.1116 9 S 4.1395 8.2519 114.5880 61.1834 62.9000 176.3897 10 A 3.9848 7.6712 123.7299 54.7514 18.0242 179.8247 11 V 3.2950 7.6475 116.7794 66.4697 31.3843 178.5055 12 T 3.9473 7.4732 113.7163 66.4493 68.4056 176.3629 13 A 4.1733 8.4266 123.1808 55.1419 18.4077 179.5257 14 L 3.7943 7.8137 119.0807 57.9124 41.7196 178.7716 15 W 4.5138 8.8444 128.1887 59.8249 30.3317 178.0349 16 G 3.7183 7.7523 105.2292 47.6233 0.0000 174.5843 17 K 4.3320 8.1429 118.5262 56.9149 32.7417 177.3427 18 V 3.6906 7.0503 118.8156 62.4375 31.9721 176.1094 19 N 4.6224 8.1516 124.9072 51.9643 38.4396 175.4671 20 V 3.5767 8.0203 121.1206 64.0410 31.5696 177.6102 21 D 4.3469 7.9836 118.5625 57.3778 40.8071 178.3488 22 E 3.9313 8.2123 118.9246 59.4426 29.7556 178.7785 23 V 3.5830 8.1243 118.7560 65.8174 31.5975 178.1524 24 G 3.7295 8.2309 105.6311 47.7704 0.0000 175.9403 25 G 3.6116 7.8182 108.2806 47.4627 0.0000 175.7195 26 E 3.9313 8.1094 120.8457 58.9564 29.5045 179.3131 27 A 3.9286 8.1367 120.9129 55.0850 18.6075 179.4959 28 L 4.0015 7.9162 118.7833 58.1635 42.0845 179.0786 29 G 3.7041 8.2297 105.7610 48.2449 0.0000 175.6740 30 R 3.8937 8.2481 121.4812 58.5227 30.0148 178.9794 31 L 3.9958 7.8437 120.0994 58.3006 42.0682 179.1700 32 L 4.0200 7.9083 118.3063 56.9677 41.2056 179.4937 33 V 3.6437 7.0238 117.6297 65.4460 31.9181 177.9054 34 V 3.4673 7.8896 116.8046 64.4295 32.7584 175.6257 35 Y 3.8406 7.0790 116.3264 53.9762 37.7339 174.0843 36 P 4.7078 0.0000 0.0000 64.5674 31.5022 178.4717 37 W 4.2965 8.0198 116.5088 59.5171 27.6763 177.8087 38 T 4.1458 7.8730 110.4936 63.7755 68.1821 175.6202 39 Q 4.1828 8.0835 121.0673 57.1682 28.4896 177.8665 40 R 3.8107 7.5545 117.5604 58.6642 29.3735 178.0059 41 F 4.5181 7.3782 116.0452 57.7650 39.9461 175.6808 42 A 4.2431 7.5980 122.9212 51.2239 19.1048 177.7521 43 E 4.1551 8.2399 119.1683 59.2072 30.1631 177.4688 44 S 4.6501 7.8627 112.8799 58.5166 63.6731 174.6390 45 F 4.5933 8.1411 119.3645 58.5010 39.9726 176.9154 46 G 3.9442 8.0648 106.5222 44.5198 0.0000 174.3974 47 D 4.4529 8.6000 125.9420 54.4800 39.6993 175.5708 48 L 4.8609 8.3718 125.5289 54.2919 43.0281 178.7511 49 S 4.3784 8.1077 116.4188 61.0078 63.0567 174.5892 50 T 4.7305 7.3574 110.0859 58.1969 73.1593 172.8567 51 P 4.2001 0.0000 0.0000 66.0687 31.2939 178.7432 52 D 4.3850 8.0660 116.7636 57.2967 40.5911 178.5198 53 A 4.0372 7.7199 119.9407 54.7782 18.4351 179.6501 54 V 3.7740 7.6961 116.8881 66.4128 31.6307 178.1558 55 M 4.1337 8.4511 117.6448 57.8968 31.8971 178.2037 56 G 3.9921 7.8097 103.3822 43.8028 0.0000 173.4358 57 N 4.3344 7.5322 121.4866 53.0688 39.4890 173.5522 58 P 4.2496 0.0000 0.0000 66.1117 31.1877 178.6476 59 K 3.6397 8.2414 118.1443 59.0333 31.7392 179.5345 60 V 3.8075 7.7160 118.0901 65.8317 31.6915 178.1305 61 K 3.9602 8.1077 118.1638 59.3727 31.7919 179.2491 62 A 3.9890 7.9473 121.1006 55.3279 18.2062 179.2459 63 H 4.2614 8.3762 116.9441 59.3403 29.9387 177.4977 64 G 3.7628 8.4609 107.9643 47.9606 0.0000 175.4515 65 K 3.9741 7.9969 121.5048 58.9469 32.2116 178.7281 66 K 3.8866 7.8802 119.7495 59.5014 32.2163 178.6493 67 V 3.6527 7.9713 118.6064 66.3823 31.4155 178.1176 68 L 4.3800 8.4449 118.3568 57.0536 41.4904 179.7255 69 G 3.6883 8.1423 106.1595 47.8894 0.0000 175.5960 70 A 4.1234 8.2345 124.1176 54.6858 18.1987 179.4755 71 F 4.3088 8.3450 118.1802 61.6028 39.8960 177.2164 72 S 4.3587 8.8237 115.2806 61.8288 62.7240 176.3636 73 D 4.4975 8.2677 121.5200 57.3137 40.5177 179.0724 74 G 3.5146 7.8612 105.9973 47.6704 0.0000 175.3998 75 L 3.8772 7.2998 118.7015 56.0328 41.6246 178.0897 76 A 4.4762 7.4826 119.3065 51.9479 20.1106 176.2728 77 H 4.8794 7.9312 115.3959 54.7887 29.9222 175.4198 78 L 4.2008 8.0667 119.9989 57.2442 41.8146 178.5080 79 D 4.5168 7.8523 117.2151 55.8607 41.9848 176.2383 80 N 4.9924 8.3639 117.2851 51.3313 39.1539 174.6451 81 L 4.0124 7.8115 123.2158 57.7854 42.1927 179.2264 82 K 3.9064 8.0617 116.9536 59.3601 32.4044 179.1799 83 G 3.6665 8.0597 105.2024 48.1091 0.0000 175.3585 84 T 3.6636 7.6391 117.8981 66.0994 68.7436 175.7892 85 F 4.6594 8.6015 117.1772 57.5311 39.0653 177.5697 86 A 4.1691 7.8387 123.1136 55.5283 18.2003 180.2775 87 T 4.0858 7.8719 107.8401 64.6403 68.9138 176.6494 88 L 4.0294 7.9106 122.9035 57.9875 42.3949 178.5161 89 S 4.3833 8.4416 114.8723 60.9694 62.2661 176.0618 90 E 3.8845 8.0457 120.7973 59.1357 29.1415 179.0767 91 L 3.8883 7.9542 120.2949 58.6507 42.1510 178.7142 92 H 4.1546 8.5626 116.4120 59.5224 28.1796 176.7410 93 C 3.6752 7.7513 120.5471 62.0565 31.0195 175.2637 94 D 4.3417 8.5690 122.5777 56.3452 40.6862 177.5013 95 K 4.3001 8.0636 117.3737 57.8624 33.5386 177.7143 96 L 4.0927 7.7455 116.3702 55.4402 42.3269 176.3418 97 H 4.2227 7.7383 113.3343 55.6607 25.8905 175.3751 98 V 3.7405 8.0610 118.8604 61.0477 32.2546 174.8417 99 D 4.3308 8.7721 127.5240 53.8088 41.6169 175.1290 100 P 3.2932 0.0000 0.0000 65.0129 31.8011 177.9847 101 E 3.8805 8.1051 118.5586 59.1847 29.2650 178.4121 102 N 4.2174 7.9209 116.6566 56.3846 38.4878 177.2656 103 F 4.4525 7.3226 118.9796 60.5462 38.9436 177.9383 104 R 4.0598 7.7844 117.3972 58.8016 30.0084 178.7387 105 L 3.7613 7.8785 118.9047 57.7296 41.6385 179.2161 106 L 4.0690 8.1140 120.3677 58.1542 41.9551 179.2556 107 G 3.7020 7.9118 105.2934 47.8893 0.0000 175.5081 108 N 4.4444 8.1930 118.9008 55.9474 38.4963 177.7345 109 V 3.6077 8.0082 119.7378 65.8725 31.5753 177.6643 110 L 3.8493 8.4052 120.4188 58.3103 41.8978 179.0872 111 V 3.5318 7.9296 117.9714 66.3221 31.3585 177.8145 112 C 4.1521 8.1035 116.4435 62.5627 27.9115 176.2655 113 V 3.5165 7.8176 120.1058 66.0075 31.0571 178.1494 114 L 3.8770 7.9319 118.7988 57.4626 41.2852 179.3910 115 A 3.6894 7.2735 120.6907 55.2167 18.1139 178.9399 116 H 4.0478 8.1335 115.8452 59.9236 29.9570 176.8808 117 H 4.0488 8.0680 116.3169 58.4823 29.0184 177.1451 118 F 4.5194 8.6721 117.9255 56.9731 39.5055 177.3338 119 G 3.7247 8.6228 109.1980 45.9603 0.0000 176.8455 120 K 3.8702 8.9403 123.4949 58.9723 32.0516 177.3287 121 E 4.1397 8.3009 118.5936 58.4033 29.9676 176.9972 122 F 4.5923 8.1049 123.3411 56.8987 37.8853 175.5560 123 T 4.1526 7.4533 115.3642 60.1741 71.2201 173.3457 124 P 4.1862 0.0000 0.0000 65.8082 31.2637 177.2406 125 P 4.2616 0.0000 0.0000 65.3241 31.2019 178.8717 126 V 3.5512 7.1804 115.9997 65.5276 31.3131 177.8480 127 Q 3.4538 7.9652 119.6187 59.0183 29.0326 178.1367 128 A 4.0018 7.9644 121.5201 55.0059 18.3194 179.5567 129 A 3.8565 7.7181 119.2940 55.7003 18.4529 179.5659 130 Y 3.9551 8.2005 115.2153 61.0888 37.9815 178.9448 131 Q 4.1065 8.6349 119.5985 59.0434 28.8069 178.9216 132 K 3.9994 7.9647 119.0840 59.3423 31.9490 179.6818 133 V 3.4707 7.6753 118.5054 66.1885 31.4514 178.6705 134 V 3.8124 8.3171 112.2000 64.1138 31.2307 178.5849 135 A 4.0843 8.0590 120.5740 55.0143 18.1851 179.7686 136 G 3.5572 8.2390 104.4804 48.0386 0.0000 176.0744 137 V 3.3219 7.9976 120.7271 65.4425 31.2891 177.9519 138 A 3.9085 7.9268 119.6379 55.2132 18.5874 179.0385 139 N 4.4155 8.4862 115.0686 56.4405 38.2354 177.5208 140 A 4.0369 8.1787 122.3694 55.1404 18.6211 179.4978 141 L 3.8884 8.1518 116.9061 56.4524 41.6170 178.2910 142 A 4.8157 7.6737 119.4291 52.3578 19.5064 178.0684 143 H 4.2429 7.9447 113.2712 58.1827 28.3978 176.2363 144 K 4.3439 7.7951 118.1027 56.1512 32.1479 176.3969 145 Y 4.2346 8.1353 117.6972 58.4565 38.4819 175.5592 146 H 4.3946 8.3741 116.8371 56.3996 28.0059 173.6188 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 8.30 4.38 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 7.99 4.52 0.00 3.15 3.21 0.00 5.72 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.19 4.53 0.00 1.56 1.50 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.96 4.04 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 1.16 0.00 0.00 5 P 0.00 4.18 0.00 2.14 2.13 0.00 3.55 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 2.09 2.13 0.00 6 E 8.10 4.01 0.00 2.13 2.19 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 2.33 2.32 0.00 7 E 7.69 3.96 0.00 2.27 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 2.27 2.26 0.00 8 K 8.29 3.90 0.00 1.72 1.96 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.36 7.81 9 S 8.25 4.14 0.00 4.08 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 10 A 7.67 3.98 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 11 V 7.65 3.29 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 0.69 0.00 0.00 0.45 0.00 0.00 12 T 7.47 3.95 4.47 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 0.00 0.00 0.00 1.23 0.00 0.00 13 A 8.43 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 14 L 7.81 3.79 0.00 1.77 1.90 0.46 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.84 4.51 0.00 3.81 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 16 G 7.75 3.72 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 0.00 0.00 0.00 17 K 8.14 4.33 0.00 2.13 2.14 0.00 1.84 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.54 1.68 7.81 18 V 7.05 3.69 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 -0.02 0.00 0.00 0.63 0.00 0.00 19 N 8.15 4.62 0.00 2.72 2.62 0.00 0.00 7.16 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 8.02 3.58 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 0.90 0.00 0.00 1.03 0.00 0.00 21 D 7.98 4.35 0.00 2.83 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 22 E 8.21 3.93 0.00 2.00 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 2.37 2.35 0.00 23 V 8.12 3.58 1.91 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 0.91 0.00 0.00 0.69 0.00 0.00 24 G 8.23 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 7.82 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 26 E 8.11 3.93 0.00 2.24 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 0.00 2.33 2.49 0.00 27 A 8.14 3.93 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 28 L 7.92 4.00 0.00 1.93 1.74 1.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.23 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 30 R 8.25 3.89 0.00 1.92 1.95 0.00 3.08 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 31 L 7.84 4.00 0.00 1.88 1.87 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.91 4.02 0.00 1.89 1.69 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.02 3.64 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 34 V 7.89 3.47 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 0.03 0.00 0.00 0.78 0.00 0.00 35 Y 7.08 3.84 0.00 2.43 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 4.71 0.00 2.31 2.31 0.00 3.76 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 2.19 1.90 0.00 37 W 8.02 4.30 0.00 3.55 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 7.87 4.15 4.28 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 1.00 0.00 0.00 39 Q 8.08 4.18 0.00 2.19 2.14 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 2.35 2.39 0.00 40 R 7.55 3.81 0.00 1.54 1.83 0.00 3.01 0.00 0.00 2.77 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.00 41 F 7.38 4.52 0.00 2.99 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.60 4.24 0.55 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 0.00 0.00 43 E 8.24 4.16 0.00 2.08 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 0.00 2.25 2.29 0.00 44 S 7.86 4.65 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.14 4.59 0.00 3.13 3.13 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 46 G 8.06 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.60 4.45 0.00 2.67 2.64 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 48 L 8.37 4.86 0.00 1.71 1.60 0.93 0.94 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 49 S 8.11 4.38 0.00 3.94 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.36 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 4.20 0.00 2.15 2.12 0.00 3.58 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 2.09 2.16 0.00 52 D 8.07 4.38 0.00 2.68 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 53 A 7.72 4.04 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 0.00 0.00 54 V 7.70 3.77 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 1.08 0.00 0.00 1.03 0.00 0.00 55 M 8.45 4.13 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.87 0.00 56 G 7.81 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 0.00 0.00 0.00 57 N 7.53 4.33 0.00 3.01 2.89 0.00 0.00 6.78 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 58 P 0.00 4.25 0.00 2.24 2.27 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 59 K 8.24 3.64 0.00 1.58 0.74 0.00 1.74 0.00 0.00 1.37 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.19 1.27 7.81 60 V 7.72 3.81 2.37 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 1.30 0.00 0.00 1.22 0.00 0.00 61 K 8.11 3.96 0.00 1.98 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.66 7.81 62 A 7.95 3.99 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 63 H 8.38 4.26 0.00 3.49 3.58 0.00 5.81 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 8.46 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 65 K 8.00 3.97 0.00 1.89 2.09 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.66 7.81 66 K 7.88 3.89 0.00 2.01 1.92 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 67 V 7.97 3.65 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 1.01 0.00 0.00 0.91 0.00 0.00 68 L 8.44 4.38 0.00 2.00 1.87 1.10 1.13 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 69 G 8.14 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 0.00 0.00 0.00 70 A 8.23 4.12 1.56 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 71 F 8.35 4.31 0.00 3.09 3.31 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 72 S 8.82 4.36 0.00 4.27 4.21 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 73 D 8.27 4.50 0.00 2.91 2.64 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 74 G 7.86 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.30 3.88 0.00 1.61 1.43 0.22 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.48 4.48 1.14 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 0.00 0.00 77 H 7.93 4.88 0.00 3.08 3.13 0.00 5.83 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.07 4.20 0.00 1.50 1.65 0.76 0.96 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 79 D 7.85 4.52 0.00 2.62 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 80 N 8.36 4.99 0.00 2.64 2.58 0.00 0.00 7.06 6.68 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 81 L 7.81 4.01 0.00 1.75 1.83 0.87 0.99 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 82 K 8.06 3.91 0.00 1.61 1.52 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.46 7.81 83 G 8.06 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 84 T 7.64 3.66 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 85 F 8.60 4.66 0.00 3.22 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.84 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.87 4.09 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 1.21 0.00 0.00 88 L 7.91 4.03 0.00 1.92 1.94 1.02 1.07 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 89 S 8.44 4.38 0.00 4.13 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 90 E 8.05 3.88 0.00 2.20 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 2.30 2.51 0.00 91 L 7.95 3.89 0.00 1.89 1.84 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.56 4.15 0.00 3.58 3.79 0.00 5.86 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 93 C 7.75 3.68 0.00 1.23 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 0.00 0.00 0.00 0.00 94 D 8.57 4.34 0.00 2.72 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 95 K 8.06 4.30 0.00 1.74 1.79 0.00 1.55 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.40 7.81 96 L 7.75 4.09 0.00 1.73 1.67 0.67 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.74 4.22 0.00 3.45 3.46 0.00 5.74 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.06 3.74 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 0.11 0.00 0.00 0.41 0.00 0.00 99 D 8.77 4.33 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.29 0.00 1.94 1.83 0.00 3.38 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.52 0.00 101 E 8.11 3.88 0.00 2.05 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 2.31 2.39 0.00 102 N 7.92 4.22 0.00 2.45 2.63 0.00 0.00 6.91 7.72 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 0.00 103 F 7.32 4.45 0.00 3.08 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 0.00 104 R 7.78 4.06 0.00 1.83 1.98 0.00 3.12 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.90 0.00 105 L 7.88 3.76 0.00 1.64 1.27 0.56 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.07 0.00 1.78 1.72 0.93 0.96 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 0.00 107 G 7.91 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 0.00 108 N 8.19 4.44 0.00 2.93 2.94 0.00 0.00 6.66 7.70 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 0.00 109 V 8.01 3.61 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 1.11 0.00 0.00 1.14 0.00 0.00 110 L 8.41 3.85 0.00 1.66 1.80 0.89 0.47 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 0.00 111 V 7.93 3.53 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 1.30 0.00 0.00 1.19 0.00 0.00 112 C 8.10 4.15 0.00 3.18 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.82 3.52 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 0.83 0.00 0.00 0.94 0.00 0.00 114 L 7.93 3.88 0.00 0.75 1.05 0.64 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.27 3.69 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 0.00 116 H 8.13 4.05 0.00 3.20 3.58 0.00 5.77 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 0.00 117 H 8.07 4.05 0.00 2.84 2.69 0.00 5.72 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 0.00 118 F 8.67 4.52 0.00 3.32 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.62 3.72 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 0.00 0.00 0.00 120 K 8.94 3.87 0.00 1.77 1.92 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.43 7.81 121 E 8.30 4.14 0.00 2.33 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 0.00 2.40 2.34 0.00 122 F 8.10 4.59 0.00 3.06 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.45 4.15 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 1.28 0.00 0.00 124 P 0.00 4.19 0.00 2.16 2.17 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 2.13 2.22 0.00 125 P 0.00 4.26 0.00 2.11 2.07 0.00 3.46 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 126 V 7.18 3.55 1.91 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 0.86 0.00 0.00 0.89 0.00 0.00 127 Q 7.97 3.45 0.00 1.83 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 128 A 7.96 4.00 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 0.00 129 A 7.72 3.86 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 0.00 130 Y 8.20 3.96 0.00 3.43 3.28 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 0.00 131 Q 8.63 4.11 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.61 0.00 132 K 7.96 4.00 0.00 1.99 1.83 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 133 V 7.68 3.47 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.74 0.00 0.00 134 V 8.32 3.81 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 1.05 0.00 0.00 1.11 0.00 0.00 135 A 8.06 4.08 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 0.00 0.00 136 G 8.24 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 8.00 3.32 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 0.59 0.00 0.00 0.61 0.00 0.00 138 A 7.93 3.91 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 0.00 0.00 139 N 8.49 4.42 0.00 2.89 2.88 0.00 0.00 6.93 8.39 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 0.00 140 A 8.18 4.04 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 0.00 141 L 8.15 3.89 0.00 1.03 0.46 0.01 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.67 4.82 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 0.00 143 H 7.94 4.24 0.00 3.35 3.68 0.00 5.75 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 0.00 144 K 7.80 4.34 0.00 1.74 1.81 0.00 1.63 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.82 1.62 7.81 145 Y 8.14 4.23 0.00 3.10 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.37 4.39 0.00 3.22 3.24 0.00 5.75 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