1 MET 1 999.9900 -1.0247 999.9900 .9587 .5203 .1514 .6749 .5137 .5870 .3286 2 ALA 2 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6633 .3122 .4585 -.4358 3 ASP 3 -1.1212 -1.2961 999.9900 999.9900 .8104 -.5356 .6798 .3859 .5084 -.1082 4 THR 4 -1.8890 999.9900 .0483 999.9900 .4476 -.4644 .6603 -.2396 .1354 -.1945 5 GLY 5 -.3679 999.9900 999.9900 999.9900 .7883 .2102 .5745 .4544 .5078 .3623 6 GLU 6 -3.2255 -1.3104 999.9900 -1.0323 .6899 -1.2196 .6792 .5144 .5831 -.6141 7 VAL 7 .0764 999.9900 .1416 999.9900 .7810 .3330 .6595 .1236 .3469 .3564 8 GLN 8 -.5591 -2.2325 999.9900 1.3059 .5113 -.2436 .6735 .5243 .5865 .0372 9 PHE 9 -.1228 -1.7109 999.9900 999.9900 .7573 -.3588 .6764 .1158 .3494 -.0568 10 MET 10 -.9371 -1.0247 999.9900 1.7963 .5203 .0887 .6743 .5233 .5862 .2587 11 LYS 11 -.8267 -2.1617 999.9900 -.4035 .7460 -.6099 .5066 .1648 .3072 -.3397 12 PRO 12 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5524 -.3785 .0094 .1589 13 PHE 13 -.0803 -3.3183 999.9900 999.9900 .7573 -.8804 .6715 .0973 .3366 -.3745 14 ILE 14 .0187 -1.6252 999.9900 999.9900 .6034 -.3344 .6511 .0354 .2919 -.0633 15 SER 15 .4640 999.9900 -.7153 999.9900 .6705 .1397 .6759 .5277 .5895 .3246 16 GLU 16 .1025 -2.8418 999.9900 1.1588 .6899 -.2227 .6763 .5199 .5850 .0509 17 LYS 17 -.5592 -1.9682 999.9900 -.4035 .7460 -.5177 .6723 .1508 .3681 -.2522 18 SER 18 -.5255 999.9900 -.0289 999.9900 .6705 .0387 .6819 .5343 .5958 .2665 19 SER 19 .9076 999.9900 -.7153 999.9900 .6705 .2876 .6772 .5240 .5878 .4128 20 LYS 20 -3.5196 -.7093 999.9900 .5368 .7460 -.4818 .6798 .1589 .3759 -.2244 21 SER 21 .0280 999.9900 1.3441 999.9900 .6705 .6809 .6807 .5316 .5937 .6510 22 LEU 22 -.6154 -3.3760 999.9900 999.9900 .9565 -1.0116 .6809 .1543 .3737 -.4399 23 GLU 23 -.4497 -1.6501 999.9900 -1.0323 .6899 -.6106 .6757 .5297 .5905 -.2062 24 ILE 24 .2593 -.3760 999.9900 999.9900 .6034 .1622 .4790 .0473 .2272 .2026 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5562 -.3713 .0152 .1616 26 LEU 26 .4996 -2.7185 999.9900 999.9900 .9565 -.4208 .6778 .1582 .3747 -.0853 27 GLY 27 .7440 999.9900 999.9900 999.9900 .7883 .7661 .5690 .4623 .5097 .6409 28 PHE 28 1.2168 -.6308 999.9900 999.9900 .7573 .4478 .6769 .1164 .3500 .4273 29 ASN 29 1.0488 -2.7010 999.9900 999.9900 .7518 -.3001 .6744 .3893 .5081 .0327 30 GLU 30 .0468 -1.9198 999.9900 -1.0323 .6899 -.5538 .6772 .5282 .5903 -.1683 31 TYR 31 -.3674 -3.5861 999.9900 999.9900 .5630 -1.1302 .6753 -.1755 .1790 -.5781 32 PHE 32 -3.6149 -.3506 999.9900 999.9900 .7573 -1.0694 .5053 .0971 .2672 -.5211 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5507 -.3936 -.0002 .2453 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4787 .3247 .3889 .2765 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5428 -.3544 .0194 .2644 36 PHE 36 -1.5081 .0697 999.9900 999.9900 .7573 -.2270 .4856 .1121 .2677 -.0167 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5380 -.3757 .0050 .2000 38 ILE 38 .3698 -1.0998 999.9900 999.9900 .6034 -.0422 .6519 .0555 .3040 .1162 39 THR 39 -.5707 999.9900 -.8810 999.9900 .4476 -.3347 .6613 -.2624 .1225 -.1210 40 VAL 40 -.0523 999.9900 -1.0788 999.9900 .7810 -.1167 .6617 .1167 .3438 .0857 41 ASP 41 -.7969 -2.6388 999.9900 999.9900 .8104 -.8751 .6767 .3842 .5061 -.3129 42 LEU 42 -.1897 -.1732 999.9900 999.9900 .9565 .1979 .6834 .1546 .3749 .2863 43 LEU 43 -.1655 -2.9612 999.9900 999.9900 .9565 -.7234 .6725 .1494 .3674 -.2697 44 ASP 44 -1.5212 -2.6388 999.9900 999.9900 .8104 -1.1165 .6741 .3723 .4980 -.4606 45 TYR 45 -3.6999 -4.1972 999.9900 999.9900 .5630 -2.4447 .6778 -.1934 .1696 -1.3700 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6738 .5296 .5897 -.5202 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5840 .4781 .5252 -.1519 48 ARG 48 -.5733 -.1448 999.9900 .1593 .8581 .0917 .6781 .5168 .5840 .2362 49 SER 49 .0374 999.9900 .6576 999.9900 .6705 .4552 .6771 .5348 .5941 .5155 50 TRP 50 -.3875 -.6490 999.9900 999.9900 .9378 -.0329 .6722 .1931 .3927 .1533 51 THR 51 -.2319 999.9900 .2916 999.9900 .4476 .1691 .6559 -.2561 .1239 .1814 52 VAL 52 -.0145 999.9900 -1.0788 999.9900 .7810 -.1041 .6594 .1236 .3468 .0942 53 ARG 53 -.5160 -1.8960 999.9900 .1593 .8581 -.2470 .6770 .5164 .5833 -.0060 54 MET 54 -.4857 -.4711 999.9900 .9587 .5203 .1306 .6744 .5117 .5795 .2847 55 LYS 55 -.3223 -.8217 999.9900 -.4035 .7460 -.2410 .6767 .1639 .3776 -.0521 56 LYS 56 -.1765 -1.8181 999.9900 -.0770 .7460 -.2805 .6716 .1512 .3681 -.0828 57 ARG 57 -.7879 -.2657 999.9900 .6901 .8581 .2369 .6710 .5188 .5822 .3392 58 GLY 58 -1.4779 999.9900 999.9900 999.9900 .7883 -.3448 .5783 .4751 .5210 .0910 59 GLU 59 -1.0162 -1.7714 999.9900 .3501 .6899 -.4369 .6763 .5255 .5883 -.0910 60 LYS 60 -.1867 .1478 999.9900 -.4035 .7460 -.0200 .6794 .1617 .3774 .1059 61 VAL 61 .3372 999.9900 -.0276 999.9900 .7810 .3636 .6608 .1204 .3456 .3744 62 PHE 62 -.3916 -1.6624 999.9900 999.9900 .7573 -.4322 .6735 .0883 .3322 -.1070 63 LEU 63 -.2181 -3.3760 999.9900 999.9900 .9565 -.8792 .6793 .1499 .3705 -.3617 64 THR 64 -3.2663 999.9900 -.8810 999.9900 .4476 -1.2333 .6587 -.2614 .1220 -.6605 65 VAL 65 -1.2071 999.9900 .5873 999.9900 .7810 .0537 .6650 .1199 .3470 .1892 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5815 .4593 .5136 -.1573 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6870 .1935 .3992 -.4520 68 GLU 68 .8733 -.9977 999.9900 -1.0323 .6899 -.1167 .6727 .5172 .5820 .1205 69 ASN 69 1.1117 .8320 999.9900 999.9900 .7518 .8985 .6773 .3882 .5087 .7522 70 PHE 70 .8041 -1.8165 999.9900 999.9900 .7573 -.0850 .6717 .1172 .3482 .1068 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6598 .1227 .3465 .2936 72 LYS 72 .6780 -1.1257 999.9900 .3240 .7460 .1893 .6769 .1532 .3714 .2538 73 ASP 73 .9921 -3.7306 999.9900 999.9900 .8104 -.6427 .6807 .3903 .5113 -.1714 74 ASN 74 .0188 -1.8756 999.9900 999.9900 .7518 -.3683 .6760 .3804 .5036 -.0097 75 ASN 75 -3.4329 -.5409 999.9900 999.9900 .7518 -1.0740 .6738 .3801 .5025 -.4336 76 LEU 76 -.9033 -.3774 999.9900 999.9900 .9565 -.1081 .6762 .1530 .3710 .1010 77 GLU 77 -1.3743 -1.5476 999.9900 -1.0323 .6899 -.8161 .6764 .5250 .5881 -.3438 78 ASP 78 -.9954 -1.8420 999.9900 999.9900 .8104 -.6757 .6810 .3855 .5086 -.1921 79 GLY 79 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5789 .4666 .5165 -.2846 80 LYS 80 -.7292 -1.9682 999.9900 -.4035 .7460 -.5517 .6789 .1636 .3783 -.2737 81 TYR 81 .2346 .8492 999.9900 999.9900 .5630 .5489 .6812 -.1635 .1885 .4329 82 LEU 82 -.5127 -3.3760 999.9900 999.9900 .9565 -.9774 .6804 .1660 .3804 -.4172 83 GLN 83 -.3535 -2.2325 999.9900 1.3059 .5113 -.1922 .6719 .5221 .5845 .0709 84 PHE 84 -.2457 -3.0602 999.9900 999.9900 .7573 -.8495 .6752 .1022 .3410 -.3542 85 ILE 85 .2593 -.6929 999.9900 999.9900 .6034 .0566 .6597 .0394 .2978 .1738 86 TYR 86 .4043 .4290 999.9900 999.9900 .5630 .4654 .6721 -.1745 .1782 .3787 87 ASP 87 -2.8635 -1.6521 999.9900 999.9900 .8104 -1.2351 .6788 .3798 .5044 -.5293 88 ARG 88 -2.9267 -1.8960 999.9900 1.1817 .8581 -.3202 .6761 .5111 .5799 -.0591 89 ASP 89 -3.3417 -3.7306 999.9900 999.9900 .8104 -2.0873 .6771 .3937 .5118 -1.0382 90 ARG 90 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .6777 .5253 .5888 -.4863 91 THR 91 .3363 999.9900 .2916 999.9900 .4476 .3585 .6553 -.2744 .1130 .2913 92 PHE 92 .2013 -1.2830 999.9900 999.9900 .7573 -.1081 .6802 .0892 .3355 .0890 93 TYR 93 .3730 -.3674 999.9900 999.9900 .5630 .1895 .6832 -.1862 .1761 .2131 94 VAL 94 -.6656 999.9900 .3968 999.9900 .7810 .1708 .6567 .1174 .3421 .2573 95 ILE 95 -.9405 -.9795 999.9900 999.9900 .6034 -.4389 .6557 .0434 .2985 -.1235 96 ILE 96 .0813 -2.0226 999.9900 999.9900 .6034 -.4460 .6571 .0478 .3017 -.1266 97 TYR 97 -.0819 .0164 999.9900 999.9900 .5630 .1658 .6745 -.1770 .1778 .1990 98 GLY 98 -.2090 999.9900 999.9900 999.9900 .7883 .2896 .5939 .4812 .5313 .4136 99 HIS 99 -3.0884 -2.4183 999.9900 999.9900 .6686 -1.6127 .6720 .3278 .4712 -.7676 100 ASN 100 -3.4329 -.0252 999.9900 999.9900 .7518 -.9021 .6774 .3726 .4996 -.3312 101 MET 101 -2.2339 -1.5870 999.9900 .9587 .5203 -.5855 .6720 .5144 .5801 -.1926 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6752 .2418 .4276 .3489 Means: -.7154 -1.5965 -.1743 .1503 .7095 -.3277 .6523 .2118 .3962 -.0355 2.00 analyzed_8