NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2144 8.2649 123.5867 52.1577 21.3384 177.0504 2 F 3.5370 7.5768 111.8597 57.4322 35.9958 174.7540 3 T 4.5218 7.1296 115.9084 63.4061 72.9167 174.1717 4 G 3.8425 7.6982 115.6433 44.4182 0.0000 170.2553 5 K 4.7589 7.1058 120.2118 55.1120 34.0000 175.3341 6 F 5.4362 9.6043 123.5271 56.2184 44.3837 172.8425 7 E 5.0767 8.4842 115.6116 55.3257 32.3647 174.2364 8 M 4.3669 9.0064 123.3754 55.8904 32.3040 176.5122 9 E 4.0510 8.4196 125.8159 58.8714 30.3015 176.6999 10 S 4.5681 7.4794 113.1033 57.6224 66.6880 172.0464 11 E 5.1158 8.3592 119.6400 55.3188 32.7838 173.9434 12 K 4.5601 8.0631 117.5455 56.3253 35.2937 175.4104 13 N 4.9571 8.0208 112.8715 53.5356 40.0895 175.9617 14 Y 3.4180 8.2035 119.8557 60.3765 38.4167 177.5701 15 D 4.2038 8.1704 117.9205 57.4924 41.3861 178.0740 16 E 3.8671 8.0519 118.2089 59.5033 29.6826 178.6179 17 F 4.0702 8.1821 120.6389 61.9179 39.2419 177.3423 18 M 3.6483 8.0442 118.3194 58.1217 31.5603 178.8176 19 K 4.0250 7.5821 117.3117 59.7407 32.4621 178.9379 20 L 4.0021 7.5448 119.5359 57.5979 41.7461 178.6584 21 L 3.8905 6.9190 117.5292 56.9691 42.9425 178.3315 22 G 3.9704 8.3444 105.2937 46.2067 0.0000 172.5603 23 I 4.3621 6.7429 118.6358 59.4958 40.2483 176.8319 24 S 4.2453 8.1972 116.5783 58.1451 64.1983 175.0873 25 S 4.2962 8.7687 122.3232 61.4666 62.0008 176.4371 26 D 4.3197 7.9556 121.4433 56.4376 39.0317 178.6146 27 V 3.6030 7.7304 119.4996 65.4311 31.6709 177.6277 28 I 4.1827 8.2029 121.3075 64.1468 36.8386 178.2445 29 E 4.1741 8.1049 117.9352 59.6872 29.5118 179.0308 30 K 4.0289 8.1770 119.0988 58.7774 31.9148 178.6610 31 A 4.0673 8.0879 120.0554 55.6888 18.2052 179.9462 32 R 3.7518 7.0865 113.4038 57.6267 29.7250 177.5065 33 N 4.9693 7.8850 116.1442 51.4944 40.5202 174.3948 34 F 5.0217 7.3087 120.5370 57.0021 42.7188 174.6328 35 K 4.2599 7.6270 126.2428 53.8444 30.7277 175.2308 36 I 3.2919 7.2345 123.5626 61.2817 38.3262 175.3629 37 V 4.3133 8.7732 127.2612 62.7382 33.5854 175.0622 38 T 5.1971 9.1625 122.0417 62.3720 72.3285 173.0083 39 E 5.2318 8.8762 125.9673 54.8718 32.9857 175.2990 40 V 4.2792 8.4382 120.1285 61.7621 35.8452 174.0640 41 Q 4.5391 8.5287 125.9494 54.4391 30.5625 172.3198 42 Q 3.5206 8.6928 125.3248 55.3055 27.8083 175.2464 43 D 4.4620 8.1083 128.2012 51.1253 38.6804 177.9470 44 G 3.7673 8.4172 112.0557 45.3983 0.0000 170.5210 45 Q 4.1935 8.8050 118.1429 59.3721 29.2679 177.5487 46 D 5.1516 8.0071 116.6230 53.9545 42.3341 175.2427 47 F 5.0636 9.4940 122.6987 54.8269 42.6932 174.3418 48 T 4.8096 8.1492 109.9409 59.6904 68.1392 173.0390 49 W 4.4544 8.1106 135.0000 58.4884 32.8439 174.5215 50 S 4.9292 9.0707 118.9551 57.7180 67.6064 173.3749 51 Q 5.0031 9.0176 120.2670 54.7002 29.7529 173.9277 52 H 4.5229 9.2779 120.1241 55.1393 30.8445 175.1871 53 Y 5.0409 8.8115 121.4881 58.2103 36.6878 175.9439 54 S 4.0292 9.2798 114.3920 59.2988 61.4745 171.4449 55 G 4.3595 8.6036 108.0192 45.7635 0.0000 174.6377 56 G 4.2044 7.5406 110.0983 44.9963 0.0000 176.6937 57 H 4.0738 9.2972 123.5733 56.8367 30.9840 172.7183 58 T 4.5414 7.5365 118.7518 61.9715 71.3733 173.2905 59 M 4.4346 8.2649 127.2265 55.3202 33.9687 175.0663 60 T 5.0027 8.3279 118.4645 61.8097 72.8468 173.7216 61 N 5.1772 8.4766 119.7614 51.5309 38.1599 174.0145 62 K 4.2528 8.1618 121.5958 56.4598 33.8455 175.7611 63 F 4.9702 7.7174 119.1166 56.6030 42.0044 172.5644 64 T 5.2812 8.7938 115.3736 61.9967 70.5583 174.2199 65 V 4.2509 8.7337 118.8550 60.5954 33.8854 176.5055 66 G 4.1249 8.7700 110.3947 46.3397 0.0000 174.1423 67 K 4.4253 7.8447 119.1431 57.3255 36.2393 175.9601 68 E 4.5780 8.3305 114.6305 55.7041 30.3591 174.3975 69 S 4.6666 8.0839 113.8986 57.7454 68.2703 173.9576 70 N 4.9676 8.7489 118.9596 53.6164 39.2592 175.0978 71 I 4.7375 9.1040 122.7997 59.8787 41.5058 176.7705 72 Q 3.7400 8.9868 125.7644 57.4132 28.9130 176.7927 73 T 3.5572 7.8953 107.0783 61.4969 68.9017 170.8005 74 M 4.5535 8.2700 119.0003 55.3517 32.8959 177.3487 75 G 4.1430 7.5756 111.1002 45.0823 0.0000 175.0016 76 G 3.7220 8.8792 108.1708 48.0377 0.0000 173.1965 77 K 4.5496 7.4872 116.3850 54.5106 36.4512 175.6705 78 T 3.9320 7.9537 115.9357 63.3807 68.9594 173.7367 79 F 5.3461 8.2558 122.5918 55.8000 43.7502 173.2340 80 K 5.2042 8.8011 119.7661 55.1784 34.1137 174.9524 81 A 4.4755 8.4401 126.0538 51.0831 21.9576 175.7722 82 T 4.3021 7.7646 116.8276 62.1244 69.2382 174.6989 83 V 3.6533 7.7976 127.0789 62.7930 33.1082 174.6991 84 Q 4.9123 8.8684 124.4479 54.8785 33.9550 172.9465 85 M 4.9911 8.4076 118.4736 54.2719 35.7921 174.5894 86 E 4.4849 8.7399 115.3480 56.9029 31.4826 176.5164 87 G 4.3133 7.3527 108.7209 44.9637 0.0000 173.6631 88 G 4.2223 7.6546 111.0682 43.5188 0.0000 172.2786 89 K 4.8549 7.6535 117.5299 56.2072 35.6032 173.3422 90 L 4.8218 9.0331 121.2087 53.5476 46.1494 175.0166 91 V 4.4805 8.3860 121.6776 61.4156 35.4242 174.1936 92 V 4.5375 8.2276 124.5768 60.6495 35.4681 172.8129 93 N 4.6886 7.5573 117.2701 51.8464 40.0869 173.5041 94 F 4.9232 8.5819 122.8092 54.1137 42.2370 174.3889 95 P 4.7377 0.0000 0.0000 60.7808 29.5039 173.8951 96 N 4.2152 7.7254 126.2486 54.1109 44.7792 174.2134 97 Y 5.0155 7.0881 114.0170 56.4943 42.0231 172.3130 98 H 5.1145 9.8398 117.9087 55.0258 33.8792 172.0166 99 Q 5.2156 8.0402 122.4395 55.3834 33.2921 173.2393 100 T 4.7482 8.3113 113.8445 60.4746 72.0324 173.4765 101 S 4.8188 8.3162 121.7539 57.6980 65.5124 173.6276 102 E 4.8950 8.8855 122.3993 55.7287 31.4705 174.3125 103 I 3.8217 7.7459 127.5089 61.0562 38.3717 176.7874 104 V 4.1216 8.3728 124.5666 61.1789 31.0158 174.4708 105 G 4.0792 8.0133 111.4718 45.1438 0.0000 171.1490 106 D 4.9713 7.5715 118.4816 50.7118 41.0926 175.7060 107 K 4.4946 7.8655 114.9447 55.5691 37.2659 174.1245 108 L 4.7386 8.9239 129.5938 53.3245 44.2642 175.4918 109 V 4.8992 8.1479 117.2202 59.8275 36.0020 174.2553 110 E 5.0773 8.4012 119.4619 55.1825 34.6203 175.4823 111 V 4.4122 8.0576 119.6480 60.8925 34.1072 174.4875 112 S 4.6774 8.1891 121.5710 57.8672 64.7040 172.4508 113 T 4.9521 8.8672 115.7699 63.8219 72.7371 173.3643 114 I 4.5676 8.5789 124.0841 62.0906 46.1838 176.1210 115 G 4.1837 8.1564 105.8557 45.2899 0.0000 172.6025 116 G 3.9367 8.8442 107.6554 46.2558 0.0000 171.1552 117 V 4.6265 7.3934 117.1723 61.5418 34.7640 173.7397 118 T 4.8013 8.3269 120.0753 62.6289 72.7658 172.8781 119 Y 4.7181 8.1304 127.7282 55.8393 39.6398 174.5929 120 E 4.6511 8.6063 126.0903 56.1585 31.7324 175.8288 121 R 4.6049 8.4881 117.6660 55.3832 33.5727 174.9009 122 V 4.6304 7.9524 111.2077 59.9793 33.2015 173.6216 123 S 4.9623 8.9517 117.8642 57.4036 63.3872 174.1062 124 K 4.4954 8.6404 124.8729 56.4685 33.7937 176.4236 125 R 4.3562 8.5069 122.5076 54.0128 29.2987 175.4212 126 L 4.1832 7.6476 126.2754 55.4452 43.1741 175.3013 127 A 4.1044 8.4400 121.0874 53.1231 18.9620 176.1710 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 A 8.26 4.21 1.30 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 2 F 7.58 3.54 0.00 3.53 3.33 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 3 T 7.13 4.52 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 1.18 0.00 0.00 4 G 7.70 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 5 K 7.11 4.76 0.00 1.94 1.47 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.28 7.81 6 F 9.60 5.44 0.00 3.01 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 7 E 8.48 5.08 0.00 1.95 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 2.27 2.28 0.00 8 M 9.01 4.37 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 9 E 8.42 4.05 0.00 1.96 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 2.49 2.28 0.00 10 S 7.48 4.57 0.00 3.88 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 11 E 8.36 5.12 0.00 1.94 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 2.46 2.21 0.00 12 K 8.06 4.56 0.00 1.75 1.89 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.38 7.81 13 N 8.02 4.96 0.00 2.86 2.94 0.00 0.00 6.60 7.74 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 14 Y 8.20 3.42 0.00 1.98 2.67 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 15 D 8.17 4.20 0.00 2.81 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 16 E 8.05 3.87 0.00 2.22 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 2.40 2.45 0.00 17 F 8.18 4.07 0.00 3.12 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 18 M 8.04 3.65 0.00 1.81 1.81 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.61 0.00 19 K 7.58 4.03 0.00 1.82 1.87 0.00 1.43 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.69 7.81 20 L 7.54 4.00 0.00 1.52 1.59 0.91 0.83 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 21 L 6.92 3.89 0.00 1.35 1.51 0.61 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.34 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 0.00 0.00 0.00 23 I 6.74 4.36 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.81 0.88 0.00 0.00 24 S 8.20 4.25 0.00 3.87 3.71 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 25 S 8.77 4.30 0.00 3.91 3.85 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 0.00 0.00 0.00 0.00 26 D 7.96 4.32 0.00 2.90 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 27 V 7.73 3.60 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 1.03 0.00 0.00 0.93 0.00 0.00 28 I 8.20 4.18 2.04 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.97 0.93 0.00 0.00 29 E 8.10 4.17 0.00 2.09 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 2.52 2.51 0.00 30 K 8.18 4.03 0.00 1.90 1.67 0.00 1.61 0.00 0.00 1.47 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.60 7.81 31 A 8.09 4.07 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 32 R 7.09 3.75 0.00 1.80 1.36 0.00 3.10 0.00 0.00 3.04 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 33 N 7.89 4.97 0.00 2.80 2.88 0.00 0.00 6.72 6.96 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 34 F 7.31 5.02 0.00 2.73 2.85 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 0.00 0.00 0.00 0.00 35 K 7.63 4.26 0.00 1.52 1.64 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.85 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.54 7.81 36 I 7.23 3.29 1.81 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 1.14 0.52 1.10 0.00 0.00 37 V 8.77 4.31 2.18 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 1.00 0.00 0.00 0.96 0.00 0.00 38 T 9.16 5.20 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 1.40 0.00 0.00 39 E 8.88 5.23 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 2.30 2.43 0.00 40 V 8.44 4.28 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 -0.35 0.00 0.00 41 Q 8.53 4.54 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 42 Q 8.69 3.52 0.00 1.76 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 7.08 0.00 0.00 0.00 0.00 0.00 1.16 1.79 0.00 43 D 8.11 4.46 0.00 2.86 2.74 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 44 G 8.42 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 45 Q 8.80 4.19 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.73 7.06 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 46 D 8.01 5.15 0.00 2.90 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 0.00 0.00 0.00 0.00 47 F 9.49 5.06 0.00 1.60 2.63 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 48 T 8.15 4.81 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 1.35 0.00 0.00 49 W 8.11 4.45 0.00 3.58 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 50 S 9.07 4.93 0.00 3.72 3.60 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 51 Q 9.02 5.00 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.14 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 52 H 9.28 4.52 0.00 3.20 3.31 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.81 5.04 0.00 3.22 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 9.28 4.03 0.00 4.17 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 0.00 55 G 8.60 4.36 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 0.00 56 G 7.54 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 9.30 4.07 0.00 3.18 2.88 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.54 4.54 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 1.16 0.00 0.00 59 M 8.26 4.43 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 60 T 8.33 5.00 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 1.34 0.00 0.00 61 N 8.48 5.18 0.00 2.67 2.91 0.00 0.00 6.88 8.83 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 62 K 8.16 4.25 0.00 1.79 1.73 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.54 7.81 63 F 7.72 4.97 0.00 3.07 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 8.79 5.28 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 1.31 0.00 0.00 65 V 8.73 4.25 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 1.01 0.00 0.00 66 G 8.77 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 67 K 7.84 4.43 0.00 1.81 1.91 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.42 7.81 68 E 8.33 4.58 0.00 2.30 2.25 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 2.12 2.14 0.00 69 S 8.08 4.67 0.00 3.87 3.83 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 70 N 8.75 4.97 0.00 2.63 2.79 0.00 0.00 6.73 7.50 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 71 I 9.10 4.74 2.19 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.02 1.11 0.00 0.00 72 Q 8.99 3.74 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 5.84 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 73 T 7.90 3.56 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 0.88 0.00 0.00 74 M 8.27 4.55 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 75 G 7.58 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.88 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 77 K 7.49 4.55 0.00 1.85 1.69 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.49 7.81 78 T 7.95 3.93 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 1.22 0.00 0.00 79 F 8.26 5.35 0.00 3.20 2.95 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 80 K 8.80 5.20 0.00 1.80 1.71 0.00 1.84 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.46 7.81 81 A 8.44 4.48 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.76 4.30 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 1.10 0.00 0.00 83 V 7.80 3.65 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 0.08 0.00 0.00 -0.12 0.00 0.00 84 Q 8.87 4.91 0.00 1.79 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.27 0.00 0.00 0.00 0.00 0.00 2.15 2.32 0.00 85 M 8.41 4.99 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 86 E 8.74 4.48 0.00 1.97 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 2.22 2.21 0.00 87 G 7.35 4.31 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 0.00 88 G 7.65 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 89 K 7.65 4.85 0.00 2.09 2.01 0.00 1.49 0.00 0.00 1.87 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.46 7.81 90 L 9.03 4.82 0.00 1.10 1.33 0.42 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.39 4.48 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 0.75 0.00 0.00 0.88 0.00 0.00 92 V 8.23 4.54 1.39 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 0.20 0.00 0.00 -0.30 0.00 0.00 93 N 7.56 4.69 0.00 2.64 2.77 0.00 0.00 6.88 7.85 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 94 F 8.58 4.92 0.00 2.86 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.74 0.00 2.11 2.06 0.00 3.96 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.00 0.00 96 N 7.73 4.22 0.00 2.41 2.61 0.00 0.00 6.67 6.93 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 97 Y 7.09 5.02 0.00 3.35 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 H 9.84 5.11 0.00 3.09 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.04 5.22 0.00 2.37 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.19 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 100 T 8.31 4.75 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 0.00 101 S 8.32 4.82 0.00 4.01 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 0.00 102 E 8.89 4.90 0.00 2.08 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 2.27 2.46 0.00 103 I 7.75 3.82 1.14 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 -0.36 0.74 0.00 0.00 104 V 8.37 4.12 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 0.93 0.00 0.00 1.03 0.00 0.00 105 G 8.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.57 4.97 0.00 2.49 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.87 4.49 0.00 1.89 1.72 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.29 1.35 7.81 108 L 8.92 4.74 0.00 0.27 0.79 1.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.15 4.90 2.25 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 0.69 0.00 0.00 1.04 0.00 0.00 110 E 8.40 5.08 0.00 1.82 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 2.36 2.31 0.00 111 V 8.06 4.41 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 0.69 0.00 0.00 0.89 0.00 0.00 112 S 8.19 4.68 0.00 3.62 2.63 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 0.00 113 T 8.87 4.95 4.53 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 0.00 0.00 0.00 1.27 0.00 0.00 114 I 8.58 4.57 2.12 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 1.25 0.71 0.88 0.00 0.00 115 G 8.16 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 0.00 0.00 0.00 0.00 116 G 8.84 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 0.00 117 V 7.39 4.63 2.25 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 1.15 0.00 0.00 1.04 0.00 0.00 118 T 8.33 4.80 4.27 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 1.26 0.00 0.00 119 Y 8.13 4.72 0.00 2.85 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 0.00 0.00 0.00 0.00 120 E 8.61 4.65 0.00 1.98 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 2.36 2.30 0.00 121 R 8.49 4.60 0.00 1.87 1.67 0.00 2.88 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 122 V 7.95 4.63 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 0.74 0.00 0.00 0.95 0.00 0.00 123 S 8.95 4.96 0.00 3.87 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 0.00 124 K 8.64 4.50 0.00 1.75 1.78 0.00 1.78 0.00 0.00 1.89 0.00 0.00 2.77 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.64 7.81 125 R 8.51 4.36 0.00 1.95 1.85 0.00 3.04 0.00 0.00 3.65 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.13 0.00 126 L 7.65 4.18 0.00 1.69 1.51 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.44 4.10 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