NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4503 8.3193 115.2927 58.6274 63.4020 173.1941 9 T 4.1681 8.2887 112.8909 59.9772 70.5315 172.0840 10 G 3.8630 8.1428 110.2188 46.6463 0.0000 174.4751 11 F 4.9426 7.8901 130.8326 58.1034 38.3463 178.2078 12 L 4.2705 7.9930 116.8049 52.0770 43.3111 175.9200 13 V 3.7301 7.5184 120.3709 61.4914 32.0267 177.2730 14 K 4.1919 8.4698 122.8977 56.0371 34.0194 177.9481 15 Q 3.9091 8.5975 122.7487 59.4290 29.0417 178.3059 16 R 3.9079 8.2619 118.8378 60.1192 29.9892 178.0356 17 A 4.2211 8.0778 119.5320 54.9173 18.2366 179.1759 18 F 4.1238 7.9170 118.1996 61.4913 39.7434 177.1845 19 L 4.2769 8.5684 118.4919 58.2183 41.6730 179.6507 20 K 4.0471 8.1172 118.5520 59.5648 32.0201 178.6470 21 L 4.0477 7.9700 119.9732 58.3963 42.0350 178.5377 22 Y 3.7414 8.1997 116.8134 61.3156 37.6774 178.1189 23 M 3.9774 8.2816 119.2721 58.4583 32.0447 178.1813 24 I 3.9152 7.6730 112.0913 64.9601 37.3043 177.6996 25 T 3.8541 7.7343 117.4434 66.3509 68.6535 176.2426 26 M 4.2536 8.5797 120.6011 58.6774 31.8459 179.0459 27 T 3.8165 8.8409 117.2140 66.3382 68.3605 176.0886 28 E 4.7607 8.7729 120.8972 59.0835 29.5946 176.5795 29 Q 4.5927 7.8228 114.6174 57.8978 32.5358 176.0130 30 E 3.9696 8.8206 119.9056 56.8713 29.7869 176.7090 31 R 3.7037 7.9432 117.8281 56.5164 27.2120 174.0862 32 L 5.1440 7.6668 121.2724 52.3512 45.8580 174.7260 33 Y 5.1323 7.3700 114.9258 54.3302 40.4492 175.6600 34 G 3.6234 8.2345 101.3947 47.6908 0.0000 175.1298 35 L 3.7730 8.3154 123.0362 57.4935 42.3290 179.2009 36 K 3.6830 7.1103 119.5587 58.8414 32.0168 178.3565 37 L 3.8155 7.5734 118.6070 58.1527 41.6540 178.8717 38 L 3.7980 7.4864 119.0323 58.7312 41.7049 178.5883 39 E 3.9073 7.9025 118.7398 59.3472 29.6554 179.3210 40 V 3.4786 7.8800 118.3739 65.8949 31.6896 178.0878 41 L 3.9196 8.5735 119.3601 57.8437 41.6786 179.5736 42 R 3.9540 8.4329 117.9003 58.5943 29.6719 178.5645 43 S 4.4550 7.1223 113.4665 60.0514 63.8573 175.3446 44 E 4.0138 7.7659 119.2159 57.2785 29.7637 176.6806 45 F 5.0210 7.6817 114.6314 57.4198 41.4199 176.8745 46 K 3.9264 7.6923 121.7846 59.6538 32.2722 177.5668 47 E 3.9144 8.3989 117.9733 59.3983 29.4127 177.8302 48 I 3.8927 7.6270 115.4338 61.6791 38.2295 176.2415 49 G 3.8257 8.2745 107.5753 46.4413 0.0000 172.8470 50 F 4.8066 8.1767 121.6329 56.3295 39.6107 175.4474 51 K 4.0665 8.2408 129.9995 53.2482 32.1003 173.4348 52 P 4.4415 0.0000 0.0000 61.6992 32.5458 175.9938 53 N 5.0588 8.0547 114.9323 50.2741 41.3670 174.4524 54 H 3.7355 8.7441 117.9800 59.5952 28.2402 177.3611 55 T 3.8376 7.2666 118.3871 66.0226 68.1109 175.9080 56 E 3.8760 7.9520 120.3234 59.2552 29.6987 178.7015 57 V 3.5341 7.9156 118.6137 66.2012 31.5498 177.3255 58 Y 4.4254 8.5066 117.2455 61.5414 37.7917 179.0941 59 R 4.0058 8.0821 118.6419 59.2616 30.1003 179.3381 60 S 4.0825 7.8325 115.0411 61.8199 62.6731 176.1329 61 L 3.6464 7.2197 119.9835 58.5173 41.7801 178.8234 62 H 4.3633 8.2925 115.4299 59.3773 28.8730 177.7121 63 E 4.2962 8.1835 121.3011 58.9188 29.1166 179.1283 64 L 4.0913 7.8649 117.8268 56.5858 41.4714 179.3330 65 L 4.2791 7.7016 119.8254 57.9846 41.6559 178.9842 66 D 4.3784 7.9994 118.0558 57.3364 41.0725 178.0029 67 D 4.4649 7.8648 116.8428 54.8204 39.6935 175.8788 68 G 3.9261 8.7821 108.1260 47.0036 0.0000 174.9349 69 I 4.6565 7.9309 118.3552 60.9115 39.8435 178.6256 70 L 5.0989 9.7536 129.4049 55.6730 42.5369 177.1484 71 K 4.6978 8.6990 122.8620 55.3288 35.7455 176.6465 72 Q 4.3345 8.4111 120.4704 55.8358 30.8545 175.4115 73 I 5.0362 7.2323 130.8308 62.4540 37.6885 173.5497 74 K 4.2939 7.5636 123.6571 55.7164 33.6762 177.3461 75 V 4.3949 8.2830 122.5359 60.9157 35.0389 174.2212 76 K 4.7048 8.7090 127.9522 54.6960 34.1959 175.1549 77 K 4.5701 8.6269 126.0443 55.1048 35.2015 175.0279 78 E 4.5337 8.8494 118.2393 55.1835 31.5008 175.1830 79 G 3.8113 8.9759 106.5637 43.2915 0.0000 173.3683 80 A 4.0927 8.7201 122.1890 55.5086 18.4846 179.5184 81 K 4.3313 7.6589 113.4646 56.0824 31.6424 179.6804 82 L 4.2788 7.4239 121.4418 54.5490 40.3629 175.2711 83 Q 4.6038 7.5960 119.9991 54.1998 31.7315 175.7911 84 E 4.8135 8.0833 117.6421 54.2838 29.6660 176.9985 85 V 3.4096 7.3122 118.5609 63.7648 33.3047 175.4044 86 V 4.2927 8.3855 126.4458 61.2845 33.1686 174.5350 87 L 5.0704 8.1900 127.5597 53.3736 43.3476 175.8107 88 Y 5.0345 8.5817 117.7574 56.3815 41.3889 174.7065 89 Q 4.5065 8.6911 119.9964 53.9944 33.1058 173.9471 90 F 4.5278 8.6227 117.9959 57.9289 39.0454 175.3386 91 K 4.2945 10.4882 126.3925 57.8138 32.5013 175.7426 92 D 4.9407 7.8045 121.9080 52.7118 42.8151 175.4792 93 Y 4.0002 8.8189 127.0907 59.6142 39.1502 176.8348 94 E 3.9880 8.3700 119.7046 59.6250 29.5948 179.1686 95 A 4.0598 8.3087 119.7717 54.9219 18.4497 179.1905 96 A 3.8978 7.6240 119.8417 54.9601 18.2041 179.4169 97 K 4.1473 7.4105 114.8531 58.2314 32.9750 178.5424 98 L 4.0771 7.6622 122.0463 58.2451 41.9491 178.0321 99 Y 4.6140 8.3451 121.1219 59.5737 38.5693 177.5872 100 K 4.5068 7.8019 114.8472 56.7354 32.0623 177.2773 101 K 4.3258 8.2227 121.1190 57.3784 34.8920 177.9417 102 Q 4.1449 7.7759 113.7666 57.4765 28.2520 177.1852 103 L 4.2535 7.3844 120.9463 55.7789 42.9773 178.3611 104 K 3.8605 7.6476 119.4153 59.3617 32.1758 178.4920 105 V 3.5812 7.7065 118.5508 66.4435 31.3549 177.9308 106 E 3.9490 8.0083 117.4188 59.3550 29.3254 179.1921 107 L 4.1941 7.9627 119.0996 57.6738 41.1105 179.3066 108 D 4.3344 8.9222 120.1988 57.2216 40.7421 178.7739 109 R 3.8978 8.3042 119.6481 59.5867 30.3065 178.7739 110 S 4.0473 8.4818 114.9454 60.6631 62.6486 176.7050 111 K 3.9688 7.8516 122.6059 59.3934 31.7288 178.5995 112 K 3.9878 7.5165 117.8711 60.0324 31.9340 178.5008 113 L 4.3513 7.4177 118.0433 58.0613 41.5726 179.2429 114 I 3.2985 7.4918 116.8938 64.3780 37.7833 178.0097 115 E 3.8964 8.4064 119.3809 59.1512 29.3353 178.6844 116 K 3.8047 9.0683 120.3293 59.9276 32.1040 178.0234 117 A 4.1260 8.8630 121.4712 55.3894 18.1429 179.2258 118 L 4.0375 7.9879 117.8512 57.5392 42.1688 178.6225 119 S 4.5520 8.0776 112.4124 60.6182 62.8099 175.2754 120 D 4.4612 8.5676 120.6682 57.8398 40.8032 178.6324 121 N 4.4138 8.3133 114.2577 54.6757 38.7080 175.3760 122 F 4.4228 7.7216 123.7488 57.5737 40.0150 174.4471 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 8 S 8.32 4.45 0.00 3.87 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 9 T 8.29 4.17 4.26 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 1.21 0.00 0.00 10 G 8.14 3.86 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 0.00 0.00 0.00 11 F 7.89 4.94 0.00 2.88 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 0.00 0.00 0.00 12 L 7.99 4.27 0.00 1.17 1.25 0.57 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.52 3.73 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 0.71 0.00 0.00 1.04 0.00 0.00 14 K 8.47 4.19 0.00 1.83 1.80 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.56 1.47 7.81 15 Q 8.60 3.91 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.55 2.32 0.00 16 R 8.26 3.91 0.00 2.01 2.00 0.00 3.50 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 17 A 8.08 4.22 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 18 F 7.92 4.12 0.00 3.16 3.35 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 19 L 8.57 4.28 0.00 1.98 1.77 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.12 4.05 0.00 2.18 1.89 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.62 1.78 7.81 21 L 7.97 4.05 0.00 1.92 1.74 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.20 3.74 0.00 3.23 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 23 M 8.28 3.98 0.00 1.90 2.14 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 2.63 2.72 0.00 24 I 7.67 3.92 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.73 0.94 0.00 0.00 25 T 7.73 3.85 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 1.11 0.00 0.00 26 M 8.58 4.25 0.00 2.03 2.26 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 2.89 2.64 0.00 27 T 8.84 3.82 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 0.41 0.00 0.00 28 E 8.77 4.76 0.00 2.32 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 0.00 2.49 2.55 0.00 29 Q 7.82 4.59 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 30 E 8.82 3.97 0.00 2.16 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 2.37 2.41 0.00 31 R 7.94 3.70 0.00 1.93 1.96 0.00 3.24 0.00 0.00 3.43 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 32 L 7.67 5.14 0.00 1.72 1.57 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 7.37 5.13 0.00 3.42 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 34 G 8.23 3.62 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 0.00 0.00 0.00 35 L 8.32 3.77 0.00 1.80 1.68 0.87 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.11 3.68 0.00 0.79 1.39 0.00 1.57 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.38 7.81 37 L 7.57 3.82 0.00 1.72 1.66 0.89 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.49 3.80 0.00 1.58 1.69 0.81 0.59 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 39 E 7.90 3.91 0.00 1.94 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 2.26 2.28 0.00 40 V 7.88 3.48 2.16 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 0.94 0.00 0.00 0.93 0.00 0.00 41 L 8.57 3.92 0.00 1.75 1.70 0.88 0.73 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 42 R 8.43 3.95 0.00 1.94 1.92 0.00 3.01 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.70 0.00 43 S 7.12 4.45 0.00 4.00 3.86 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 44 E 7.77 4.01 0.00 1.77 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 2.11 1.91 0.00 45 F 7.68 5.02 0.00 3.24 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 46 K 7.69 3.93 0.00 2.11 1.83 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.43 7.81 47 E 8.40 3.91 0.00 1.96 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 2.41 0.00 48 I 7.63 3.89 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.99 1.33 0.00 0.00 49 G 8.27 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 0.00 0.00 0.00 50 F 8.18 4.81 0.00 2.67 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 51 K 8.24 4.07 0.00 1.63 1.61 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.26 7.81 52 P 0.00 4.44 0.00 2.02 1.84 0.00 3.18 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.34 0.00 53 N 8.05 5.06 0.00 2.85 2.87 0.00 0.00 5.65 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.74 3.74 0.00 2.96 3.44 0.00 5.48 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.27 3.84 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 1.23 0.00 0.00 56 E 7.95 3.88 0.00 2.06 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 2.52 2.46 0.00 57 V 7.92 3.53 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.85 0.00 0.00 58 Y 8.51 4.43 0.00 3.19 2.80 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 59 R 8.08 4.01 0.00 2.06 2.02 0.00 3.17 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.94 0.00 60 S 7.83 4.08 0.00 3.85 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 61 L 7.22 3.65 0.00 1.58 1.32 0.43 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.29 4.36 0.00 3.33 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.18 4.30 0.00 2.26 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 2.35 2.44 0.00 64 L 7.86 4.09 0.00 1.79 1.62 0.89 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.70 4.28 0.00 2.05 1.74 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.00 4.38 0.00 2.71 2.73 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 67 D 7.86 4.46 0.00 2.62 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 68 G 8.78 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 69 I 7.93 4.66 2.03 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.08 0.95 0.00 0.00 70 L 9.75 5.10 0.00 1.54 1.74 0.74 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 71 K 8.70 4.70 0.00 1.83 1.94 0.00 1.52 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.45 1.47 7.81 72 Q 8.41 4.33 0.00 1.87 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.76 0.00 0.00 0.00 0.00 0.00 1.81 2.35 0.00 73 I 7.23 5.04 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.81 0.00 0.00 74 K 7.56 4.29 0.00 1.62 1.65 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.34 1.33 7.81 75 V 8.28 4.39 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 0.89 0.00 0.00 0.89 0.00 0.00 76 K 8.71 4.70 0.00 1.71 1.63 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.69 7.81 77 K 8.63 4.57 0.00 1.83 1.75 0.00 1.43 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 1.43 7.81 78 E 8.85 4.53 0.00 1.92 1.88 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 2.21 2.32 0.00 79 G 8.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.72 4.09 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 81 K 7.66 4.33 0.00 1.73 1.80 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.49 7.81 82 L 7.42 4.28 0.00 1.78 1.59 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.60 4.60 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 7.29 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 84 E 8.08 4.81 0.00 1.90 1.88 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 2.20 2.14 0.00 85 V 7.31 3.41 1.73 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 0.18 0.00 0.00 0.12 0.00 0.00 86 V 8.39 4.29 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 0.59 0.00 0.00 0.90 0.00 0.00 87 L 8.19 5.07 0.00 1.53 1.60 0.92 1.06 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 88 Y 8.58 5.03 0.00 2.70 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 89 Q 8.69 4.51 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.01 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 90 F 8.62 4.53 0.00 3.16 3.22 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 K 10.49 4.29 0.00 2.16 1.85 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.56 7.81 92 D 7.80 4.94 0.00 3.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.82 4.00 0.00 3.02 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 94 E 8.37 3.99 0.00 2.36 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 95 A 8.31 4.06 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 96 A 7.62 3.90 1.05 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 0.00 0.00 97 K 7.41 4.15 0.00 1.82 1.81 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.65 1.43 7.81 98 L 7.66 4.08 0.00 1.95 1.85 0.94 0.62 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 99 Y 8.35 4.61 0.00 3.08 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 0.00 100 K 7.80 4.51 0.00 1.95 1.78 0.00 1.67 0.00 0.00 1.59 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.64 7.81 101 K 8.22 4.33 0.00 1.82 1.66 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.31 7.81 102 Q 7.78 4.14 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.36 0.00 0.00 0.00 0.00 0.00 2.22 2.10 0.00 103 L 7.38 4.25 0.00 1.54 1.57 0.90 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 104 K 7.65 3.86 0.00 1.76 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.46 7.81 105 V 7.71 3.58 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 1.02 0.00 0.00 0.89 0.00 0.00 106 E 8.01 3.95 0.00 1.98 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 2.36 2.34 0.00 107 L 7.96 4.19 0.00 1.84 1.72 0.90 0.96 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 0.00 108 D 8.92 4.33 0.00 2.82 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 8.30 3.90 0.00 1.96 2.00 0.00 3.20 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 110 S 8.48 4.05 0.00 3.88 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 0.00 111 K 7.85 3.97 0.00 1.98 1.89 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 112 K 7.52 3.99 0.00 2.04 1.87 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.71 7.81 113 L 7.42 4.35 0.00 1.82 1.65 0.73 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.49 3.30 1.81 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 1.49 1.32 0.94 0.00 0.00 115 E 8.41 3.90 0.00 2.26 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 2.32 2.30 0.00 116 K 9.07 3.80 0.00 1.80 2.01 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.47 1.71 7.81 117 A 8.86 4.13 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 0.00 118 L 7.99 4.04 0.00 2.01 1.88 0.62 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.08 4.55 0.00 3.96 4.02 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 0.00 120 D 8.57 4.46 0.00 2.74 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 0.00 121 N 8.31 4.41 0.00 2.67 2.37 0.00 0.00 6.91 8.28 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 0.00 122 F 7.72 4.42 0.00 3.19 2.87 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