1 MET 1 999.9900 -.9517 999.9900 .9587 .5203 .1758 .6701 .4957 .5750 .3386 2 ALA 2 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .6639 .3093 .4571 .3189 3 ASP 3 -1.6875 -.6817 999.9900 999.9900 .8104 -.5196 .6776 .3765 .5020 -.1009 4 THR 4 -.3846 999.9900 -.8810 999.9900 .4476 -.2727 .6609 -.2582 .1248 -.0831 5 GLY 5 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .5751 .4558 .5088 .0725 6 GLU 6 -1.2516 -.8834 999.9900 -1.0323 .6899 -.6194 .6740 .5195 .5839 -.2140 7 VAL 7 -.0582 999.9900 -.0276 999.9900 .7810 .2317 .6531 .1278 .3466 .2952 8 GLN 8 -.3535 .7444 999.9900 1.3059 .5113 .5520 .6758 .5170 .5831 .5668 9 PHE 9 .2240 .1483 999.9900 999.9900 .7573 .3766 .6755 .0988 .3391 .3808 10 MET 10 -.1025 -2.5481 999.9900 .9587 .5203 -.2929 .6778 .5114 .5807 .0029 11 LYS 11 -.6340 -.4196 999.9900 .1731 .7460 .0077 .4870 .1571 .2945 .0975 12 PRO 12 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5336 -.3461 .0204 .1623 13 PHE 13 .0490 -4.3038 999.9900 999.9900 .7573 -1.1658 .6698 .1008 .3379 -.5454 14 ILE 14 -.5593 -.5821 999.9900 999.9900 .6034 -.1793 .6625 .0459 .3028 .0341 15 SER 15 .1386 999.9900 -.7153 999.9900 .6705 .0313 .6774 .5346 .5941 .2612 16 GLU 16 .8171 -1.7714 999.9900 -1.0323 .6899 -.3242 .6767 .5192 .5849 -.0168 17 LYS 17 -1.4447 -2.1617 999.9900 -.0397 .7460 -.5880 .6755 .1646 .3775 -.3000 18 SER 18 -.5255 999.9900 -.7153 999.9900 .6705 -.1901 .6724 .5365 .5932 .1277 19 SER 19 .6980 999.9900 -.7153 999.9900 .6705 .2177 .6772 .5380 .5960 .3737 20 LYS 20 -3.5196 -2.9005 999.9900 .8416 .7460 -.7982 .6791 .1512 .3711 -.4515 21 SER 21 -.7443 999.9900 -.7153 999.9900 .6705 -.2630 .6794 .5459 .6015 .0872 22 LEU 22 -.0536 -3.3760 999.9900 999.9900 .9565 -.8243 .6709 .1513 .3678 -.3302 23 GLU 23 -.3890 -1.9198 999.9900 -1.0323 .6899 -.6628 .6785 .5250 .5889 -.2413 24 ILE 24 .3543 -.4959 999.9900 999.9900 .6034 .1539 .4605 .0487 .2203 .1942 25 PRO 25 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5420 -.3656 .0126 .2501 26 LEU 26 .0133 -2.2115 999.9900 999.9900 .9565 -.4139 .6794 .1514 .3714 -.0822 27 GLY 27 .1734 999.9900 999.9900 999.9900 .7883 .4808 .5858 .4737 .5235 .5053 28 PHE 28 -1.7494 -1.6624 999.9900 999.9900 .7573 -.8848 .6773 .1060 .3441 -.3742 29 ASN 29 1.1272 -1.8756 999.9900 999.9900 .7518 .0012 .6770 .3858 .5071 .2133 30 GLU 30 .0468 -1.7714 999.9900 -1.0323 .6899 -.5167 .6756 .5217 .5858 -.1449 31 TYR 31 .3338 -4.1972 999.9900 999.9900 .5630 -1.1002 .6767 -.1828 .1753 -.5613 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4964 .1031 .2669 -.5501 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5292 -.3861 -.0047 .2418 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4864 .3156 .3868 .2761 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5503 -.3658 .0159 .2635 36 PHE 36 -1.5081 -4.3038 999.9900 999.9900 .7573 -1.6849 .4869 .1015 .2621 -.8932 37 PRO 37 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5462 -.3560 .0199 .2649 38 ILE 38 .5785 -1.4972 999.9900 999.9900 .6034 -.1051 .6551 .0516 .3030 .0783 39 THR 39 .0643 999.9900 -.8810 999.9900 .4476 -.1231 .6603 -.2531 .1275 .0076 40 VAL 40 .0764 999.9900 .8662 999.9900 .7810 .5745 .6543 .1124 .3382 .4981 41 ASP 41 -.6569 -2.1980 999.9900 999.9900 .8104 -.6815 .6776 .3871 .5081 -.1960 42 LEU 42 -.3571 .3561 999.9900 999.9900 .9565 .3185 .6776 .1542 .3723 .3575 43 LEU 43 .0762 -2.9612 999.9900 999.9900 .9565 -.6428 .6765 .1446 .3662 -.2215 44 ASP 44 -1.3478 -1.7735 999.9900 999.9900 .8104 -.7703 .6664 .3769 .4975 -.2535 45 TYR 45 -3.6999 -1.3246 999.9900 999.9900 .5630 -1.4872 .6761 -.1791 .1773 -.7929 46 SER 46 -2.9368 999.9900 -.7153 999.9900 .6705 -.9939 .6816 .5313 .5939 -.3537 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5885 .4801 .5283 -.1503 48 ARG 48 -.5733 -1.1946 999.9900 .1593 .8581 -.1182 .6698 .5128 .5782 .0845 49 SER 49 .0374 999.9900 -.7153 999.9900 .6705 -.0025 .6771 .5367 .5952 .2413 50 TRP 50 -.1951 -.6490 999.9900 999.9900 .9378 .0312 .6786 .1905 .3938 .1925 51 THR 51 .0164 999.9900 .0483 999.9900 .4476 .1707 .6574 -.2707 .1160 .1798 52 VAL 52 -.0145 999.9900 -1.0788 999.9900 .7810 -.1041 .6543 .1387 .3535 .0962 53 ARG 53 -.5160 -1.6149 999.9900 .1593 .8581 -.1908 .6676 .5106 .5760 .0320 54 MET 54 -.3503 -.1900 999.9900 .9587 .5203 .2347 .6807 .5231 .5888 .3571 55 LYS 55 -.6340 .4277 999.9900 -.4035 .7460 -.0535 .6749 .1526 .3702 .0800 56 LYS 56 -.2075 .5085 999.9900 -.4035 .7460 .0480 .6805 .1558 .3744 .1538 57 ARG 57 -1.0405 -2.0954 999.9900 .1593 .8581 -.3918 .6821 .5226 .5890 -.1078 58 GLY 58 -.2363 999.9900 999.9900 999.9900 .7883 .2760 .5887 .4747 .5253 .4038 59 GLU 59 -.7734 -.5163 999.9900 -1.0323 .6899 -.4080 .6739 .5170 .5823 -.0735 60 LYS 60 -.2345 -.4905 999.9900 -.4035 .7460 -.1572 .6750 .1556 .3720 .0064 61 VAL 61 .0764 999.9900 .5873 999.9900 .7810 .4816 .6600 .1175 .3435 .4445 62 PHE 62 -.3916 -2.0028 999.9900 999.9900 .7573 -.5457 .6776 .1060 .3442 -.1707 63 LEU 63 -.4065 -2.1315 999.9900 999.9900 .9565 -.5272 .6781 .1557 .3734 -.1495 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6623 -.2627 .1227 -.8481 65 VAL 65 -1.2071 999.9900 .3968 999.9900 .7810 -.0098 .6550 .1226 .3444 .1497 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5739 .4687 .5155 -.1568 67 TRP 67 .2222 -3.3859 999.9900 999.9900 .9378 -.7419 .6787 .1839 .3901 -.2726 68 GLU 68 1.0761 -.5578 999.9900 -1.0323 .6899 .0439 .6782 .5162 .5837 .2284 69 ASN 69 1.3908 -1.8756 999.9900 999.9900 .7518 .0890 .6727 .3761 .4997 .2632 70 PHE 70 .8041 -.6308 999.9900 999.9900 .7573 .3102 .6791 .1082 .3461 .3436 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6610 .1262 .3490 .2946 72 LYS 72 .6780 -1.5918 999.9900 -.4035 .7460 -.1950 .6824 .1621 .3789 -.0186 73 ASP 73 .9921 -3.7306 999.9900 999.9900 .8104 -.6427 .6723 .3772 .5001 -.1757 74 ASN 74 -.1320 -1.0869 999.9900 999.9900 .7518 -.1557 .6791 .3818 .5056 .1187 75 ASN 75 -1.8173 -.1227 999.9900 999.9900 .7518 -.3960 .6766 .3799 .5035 -.0263 76 LEU 76 -.3075 -2.5464 999.9900 999.9900 .9565 -.6325 .6734 .1362 .3600 -.2176 77 GLU 77 -1.1499 -2.3808 999.9900 -1.0323 .6899 -.9683 .6729 .5170 .5819 -.4472 78 ASP 78 -.7312 -2.6388 999.9900 999.9900 .8104 -.8532 .6729 .3771 .5003 -.3019 79 GLY 79 -2.0431 999.9900 999.9900 999.9900 .7883 -.6274 .5838 .4803 .5263 -.0477 80 LYS 80 -.7069 -1.3520 999.9900 .1731 .7460 -.1933 .6737 .1483 .3672 -.0207 81 TYR 81 .0868 -.5584 999.9900 999.9900 .5630 .0304 .6821 -.1824 .1778 .1182 82 LEU 82 -.7369 -3.3760 999.9900 999.9900 .9565 -1.0521 .6715 .1637 .3753 -.4642 83 GLN 83 -.4190 -.8354 999.9900 1.3059 .5113 .1407 .6743 .5178 .5830 .2925 84 PHE 84 -.2457 -1.4910 999.9900 999.9900 .7573 -.3264 .6726 .0978 .3373 -.0418 85 ILE 85 .3543 -1.1818 999.9900 999.9900 .6034 -.0747 .6596 .0446 .3009 .0960 86 TYR 86 .0686 -1.4719 999.9900 999.9900 .5630 -.2801 .6721 -.1887 .1700 -.0714 87 ASP 87 -.6028 -.2893 999.9900 999.9900 .8104 -.0272 .6774 .3876 .5083 .1967 88 ARG 88 -1.1554 -2.8571 999.9900 .1593 .8581 -.5672 .6725 .5103 .5779 -.2362 89 ASP 89 -2.5838 -1.0260 999.9900 999.9900 .8104 -.9332 .6825 .3858 .5094 -.3462 90 ARG 90 -1.7561 -2.3766 999.9900 .1593 .8581 -.5912 .6766 .5244 .5878 -.2507 91 THR 91 .3531 999.9900 -.8810 999.9900 .4476 -.0268 .6519 -.2441 .1292 .0655 92 PHE 92 .1161 .0967 999.9900 999.9900 .7573 .3234 .6795 .1097 .3471 .3519 93 TYR 93 .3730 -4.1972 999.9900 999.9900 .5630 -1.0871 .6757 -.1685 .1833 -.5508 94 VAL 94 -.3909 999.9900 .5873 999.9900 .7810 .3258 .6581 .1187 .3434 .3508 95 ILE 95 -1.5441 -.4698 999.9900 999.9900 .6034 -.4702 .6581 .0445 .3002 -.1416 96 ILE 96 .3543 -1.7297 999.9900 999.9900 .6034 -.2573 .6644 .0286 .2935 -.0158 97 TYR 97 .2346 -.4266 999.9900 999.9900 .5630 .1237 .6787 -.1864 .1741 .1727 98 GLY 98 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5919 .4777 .5284 -.1501 99 HIS 99 -.0795 -3.1083 999.9900 999.9900 .6686 -.8397 .6707 .3255 .4693 -.3046 100 ASN 100 .1294 -1.3461 999.9900 999.9900 .7518 -.1550 .6803 .3840 .5075 .1199 101 MET 101 -.7980 -.2135 999.9900 .9587 .5203 .1169 .6790 .5234 .5882 .2783 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6814 .2336 .4255 .3482 Means: -.5084 -1.5467 -.3887 -.0031 .7095 -.2848 .6514 .2114 .3956 -.0092 2.00 analyzed_20