1 MET 1 999.9900 .0433 999.9900 .9587 .5203 .5074 .6732 .5069 .5825 .5405 2 ALA 2 -.7438 999.9900 999.9900 999.9900 .7458 .0010 .6654 .3288 .4691 .2490 3 ASP 3 -.3726 -3.1847 999.9900 999.9900 .8104 -.9156 .6701 .3792 .5004 -.3395 4 THR 4 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6560 -.2628 .1200 -.8494 5 GLY 5 -1.2645 999.9900 999.9900 999.9900 .7883 -.2381 .5861 .4733 .5235 .1458 6 GLU 6 -3.2255 -1.3104 999.9900 .3501 .6899 -.8740 .6803 .5277 .5913 -.3813 7 VAL 7 .0815 999.9900 -.2457 999.9900 .7810 .2056 .6528 .1220 .3432 .2783 8 GLN 8 -.4306 -2.6982 999.9900 1.3059 .5113 -.3279 .6766 .5296 .5909 -.0176 9 PHE 9 .2013 -3.0602 999.9900 999.9900 .7573 -.7005 .6837 .1066 .3470 -.2623 10 MET 10 -.1559 -.6258 999.9900 .9587 .5203 .1743 .6774 .5122 .5810 .3145 11 LYS 11 -.7523 -.8858 999.9900 -.0397 .7460 -.1943 .4956 .1556 .2973 -.0458 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5477 -.3744 .0098 .2493 13 PHE 13 -.0017 -3.6820 999.9900 999.9900 .7573 -.9755 .6798 .1113 .3482 -.4271 14 ILE 14 .0813 -1.5368 999.9900 999.9900 .6034 -.2840 .6533 .0489 .3008 -.0300 15 SER 15 .6370 999.9900 -.7153 999.9900 .6705 .1974 .6775 .5360 .5949 .3611 16 GLU 16 .8733 -.7281 999.9900 1.1588 .6899 .4985 .6738 .5258 .5875 .5322 17 LYS 17 -2.0221 -1.9682 999.9900 -.4035 .7460 -.8103 .6795 .1665 .3803 -.4579 18 SER 18 -.1309 999.9900 -.7153 999.9900 .6705 -.0586 .6724 .5255 .5867 .2044 19 SER 19 .5661 999.9900 -.7153 999.9900 .6705 .1737 .6831 .5305 .5941 .3470 20 LYS 20 -3.5196 -2.4344 999.9900 .7184 .7460 -.7542 .6730 .1571 .3721 -.4201 21 SER 21 -.4771 999.9900 -.7153 999.9900 .6705 -.1740 .6751 .5289 .5898 .1364 22 LEU 22 -.1655 -1.7554 999.9900 999.9900 .9565 -.3215 .6785 .1535 .3722 -.0265 23 GLU 23 -.5863 -.7009 999.9900 -1.0323 .6899 -.4074 .6785 .5176 .5847 -.0723 24 ILE 24 .2768 -.6929 999.9900 999.9900 .6034 .0624 .4725 .0364 .2181 .1393 25 PRO 25 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5529 -.3655 .0171 .2642 26 LEU 26 .4996 -2.9612 999.9900 999.9900 .9565 -.5017 .6723 .1616 .3744 -.1342 27 GLY 27 .9829 999.9900 999.9900 999.9900 .7883 .8856 .5857 .4773 .5254 .7085 28 PHE 28 -.7647 -1.2526 999.9900 999.9900 .7573 -.4200 .6762 .0953 .3373 -.0977 29 ASN 29 .9310 -.1227 999.9900 999.9900 .7518 .5201 .6747 .3856 .5061 .5241 30 GLU 30 -.3012 -2.3808 999.9900 -1.0323 .6899 -.7561 .6787 .5297 .5918 -.3027 31 TYR 31 -.0710 -4.1972 999.9900 999.9900 .5630 -1.2351 .6771 -.1860 .1737 -.6428 32 PHE 32 -3.6149 -.9508 999.9900 999.9900 .7573 -1.2694 .4744 .1017 .2570 -.6464 33 PRO 33 -3.8843 999.9900 999.9900 999.9900 .4496 -1.7173 .5499 -.3658 .0157 -.8126 34 ALA 34 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .4862 .3183 .3882 -.4786 35 PRO 35 -4.5055 999.9900 999.9900 999.9900 .4496 -2.0279 .5420 -.3666 .0120 -.9701 36 PHE 36 -1.4107 -1.8165 999.9900 999.9900 .7573 -.8233 .4875 .1086 .2665 -.3748 37 PRO 37 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5493 -.3681 .0142 .2513 38 ILE 38 -4.2337 -1.4972 999.9900 999.9900 .6034 -1.7092 .6594 .0408 .2985 -.8855 39 THR 39 -.2075 999.9900 -.2947 999.9900 .4476 -.0182 .6552 -.2603 .1212 .0681 40 VAL 40 -.3909 999.9900 -1.0788 999.9900 .7810 -.2295 .6547 .1165 .3407 .0165 41 ASP 41 -.9091 -.5192 999.9900 999.9900 .8104 -.2059 .6783 .3794 .5040 .0880 42 LEU 42 -.1655 -3.3760 999.9900 999.9900 .9565 -.8617 .6786 .1532 .3721 -.3507 43 LEU 43 -.8032 -1.5262 999.9900 999.9900 .9565 -.4576 .6798 .1493 .3703 -.1088 44 ASP 44 -.5058 -.5889 999.9900 999.9900 .8104 -.0948 .6808 .3876 .5098 .1568 45 TYR 45 -2.3553 -4.1972 999.9900 999.9900 .5630 -1.9965 .6705 -.1671 .1819 -1.0972 46 SER 46 -2.9368 999.9900 -.7153 999.9900 .6705 -.9939 .6772 .5341 .5937 -.3541 47 GLY 47 -1.3026 999.9900 999.9900 999.9900 .7883 -.2571 .5740 .4646 .5132 .1311 48 ARG 48 -.4155 -1.0788 999.9900 .7862 .8581 .1872 .6774 .5200 .5856 .3048 49 SER 49 .0374 999.9900 -.0289 999.9900 .6705 .2264 .6786 .5271 .5902 .3770 50 TRP 50 -.3568 -3.3859 999.9900 999.9900 .9378 -.9350 .6803 .1783 .3874 -.3893 51 THR 51 -1.0713 999.9900 -.2947 999.9900 .4476 -.3061 .6614 -.2623 .1225 -.1039 52 VAL 52 -.9687 999.9900 .4980 999.9900 .7810 .1035 .6646 .1373 .3570 .2225 53 ARG 53 -.4343 -1.7413 999.9900 .6901 .8581 .0125 .6796 .5196 .5863 .1803 54 MET 54 -.3206 -1.4323 999.9900 .9587 .5203 -.0685 .6784 .5231 .5878 .1546 55 LYS 55 -.2345 -1.2879 999.9900 -.4035 .7460 -.3167 .6715 .1639 .3754 -.1069 56 LYS 56 -.6747 -1.5918 999.9900 -.0397 .7460 -.3200 .6728 .1450 .3649 -.1117 57 ARG 57 -2.0927 -2.0954 999.9900 .1593 .8581 -.6023 .6752 .5132 .5807 -.2604 58 GLY 58 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5841 .4766 .5244 -.4093 59 GLU 59 -1.0162 -.9977 999.9900 .3501 .6899 -.2435 .6776 .5308 .5920 .0391 60 LYS 60 -.6340 -1.8181 999.9900 -.4035 .7460 -.5026 .6769 .1549 .3724 -.2402 61 VAL 61 -1.1433 999.9900 -1.0788 999.9900 .7810 -.4803 .6526 .1263 .3456 -.1324 62 PHE 62 -.3916 .1357 999.9900 999.9900 .7573 .1671 .6802 .1013 .3425 .2566 63 LEU 63 -1.0430 -.6635 999.9900 999.9900 .9565 -.2500 .6726 .1447 .3647 .0135 64 THR 64 -4.2065 999.9900 .0483 999.9900 .4476 -1.2369 .6542 -.2587 .1216 -.6630 65 VAL 65 -1.2071 999.9900 -1.0788 999.9900 .7810 -.5016 .6564 .1263 .3472 -.1444 66 GLY 66 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5895 .4724 .5245 -.2053 67 TRP 67 .2222 -1.9067 999.9900 999.9900 .9378 -.2489 .6751 .1844 .3888 .0226 68 GLU 68 .8733 -1.4588 999.9900 -1.0323 .6899 -.2320 .6777 .5314 .5923 .0469 69 ASN 69 .1294 .8320 999.9900 999.9900 .7518 .5711 .6776 .3829 .5057 .5547 70 PHE 70 .6259 -4.3038 999.9900 999.9900 .7573 -.9735 .6762 .1053 .3432 -.4278 71 VAL 71 .8065 999.9900 -1.0788 999.9900 .7810 .1696 .6538 .1250 .3453 .2575 72 LYS 72 .6780 -1.5918 999.9900 -.4035 .7460 -.1950 .6718 .1529 .3691 -.0215 73 ASP 73 1.3227 -1.9171 999.9900 999.9900 .8104 .0720 .6748 .3673 .4955 .2516 74 ASN 74 .3429 -2.3357 999.9900 999.9900 .7518 -.4137 .6762 .3847 .5061 -.0360 75 ASN 75 -2.1824 .0199 999.9900 999.9900 .7518 -.4702 .6793 .3839 .5070 -.0695 76 LEU 76 -2.2364 -1.4996 999.9900 999.9900 .9565 -.9265 .6768 .1513 .3702 -.3903 77 GLU 77 -1.2742 .8034 999.9900 -1.0323 .6899 -.2033 .6692 .5198 .5820 .0626 78 ASP 78 -1.5212 -2.0928 999.9900 999.9900 .8104 -.9345 .6803 .3887 .5102 -.3469 79 GLY 79 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5701 .4704 .5147 -.0288 80 LYS 80 -.7069 -.0727 999.9900 -.4035 .7460 -.1681 .6768 .1569 .3736 -.0010 81 TYR 81 .0868 -.6802 999.9900 999.9900 .5630 -.0102 .6774 -.1784 .1782 .0937 82 LEU 82 -.1655 -3.3760 999.9900 999.9900 .9565 -.8617 .6809 .1544 .3738 -.3499 83 GLN 83 -.3535 -2.6982 999.9900 1.3059 .5113 -.3086 .6819 .5261 .5910 -.0044 84 PHE 84 -.2457 -1.2526 999.9900 999.9900 .7573 -.2470 .6780 .1024 .3422 .0079 85 ILE 85 .3543 -1.6252 999.9900 999.9900 .6034 -.2225 .6580 .0425 .2989 .0066 86 TYR 86 .2641 -4.1972 999.9900 999.9900 .5630 -1.1234 .6739 -.1906 .1696 -.5774 87 ASP 87 -1.8260 -.2316 999.9900 999.9900 .8104 -.4157 .6798 .3824 .5063 -.0370 88 ARG 88 -1.7561 -1.6149 999.9900 .1593 .8581 -.4388 .6719 .5127 .5790 -.1442 89 ASP 89 -2.3854 -1.3712 999.9900 999.9900 .8104 -.9821 .6757 .3777 .5019 -.3786 90 ARG 90 -1.7561 -1.8960 999.9900 .1593 .8581 -.4951 .6802 .5206 .5871 -.1821 91 THR 91 .3447 999.9900 -.8810 999.9900 .4476 -.0296 .6558 -.2515 .1265 .0631 92 PHE 92 .0058 -1.2232 999.9900 999.9900 .7573 -.1534 .6757 .1171 .3499 .0665 93 TYR 93 .3730 -1.1415 999.9900 999.9900 .5630 -.0685 .6729 -.1826 .1739 .0569 94 VAL 94 -.1853 999.9900 .8662 999.9900 .7810 .4873 .6601 .1341 .3533 .4512 95 ILE 95 -1.5441 -1.5793 999.9900 999.9900 .6034 -.8400 .6603 .0363 .2963 -.3647 96 ILE 96 -.1408 -.9795 999.9900 999.9900 .6034 -.1723 .6585 .0259 .2895 .0335 97 TYR 97 -.5773 .2608 999.9900 999.9900 .5630 .0821 .6738 -.1843 .1733 .1472 98 GLY 98 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5906 .4728 .5252 -.2050 99 HIS 99 -3.0884 -3.1083 999.9900 999.9900 .6686 -1.8427 .6742 .3260 .4711 -.9056 100 ASN 100 -1.0675 -1.3461 999.9900 999.9900 .7518 -.5539 .6678 .3736 .4962 -.1241 101 MET 101 -1.9811 -2.5481 999.9900 .9587 .5203 -.7626 .6762 .5128 .5809 -.3102 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6757 .2337 .4231 .3463 Means: -.8909 -1.6333 -.4724 .1366 .7095 -.4078 .6518 .2118 .3960 -.0850 2.00 analyzed_8