1 MET 1 999.9900 -2.0676 999.9900 .9587 .5203 -.1962 .6725 .5055 .5814 .1179 2 ALA 2 -.8335 999.9900 999.9900 999.9900 .7458 -.0439 .6708 .3185 .4653 .2254 3 ASP 3 -3.3417 -1.7735 999.9900 999.9900 .8104 -1.4349 .6752 .3792 .5026 -.6501 4 THR 4 -.3275 999.9900 -.2947 999.9900 .4476 -.0582 .6619 -.2521 .1287 .0470 5 GLY 5 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .5857 .4762 .5248 .3592 6 GLU 6 -3.2255 -1.4588 999.9900 .3501 .6899 -.9111 .6816 .5230 .5891 -.4066 7 VAL 7 -.0463 999.9900 .1416 999.9900 .7810 .2921 .6536 .1344 .3508 .3329 8 GLN 8 -.5591 -2.2325 999.9900 1.3059 .5113 -.2436 .6763 .5142 .5817 .0360 9 PHE 9 .1414 -.8310 999.9900 999.9900 .7573 .0226 .6810 .1010 .3427 .1700 10 MET 10 -.2922 -2.5481 999.9900 .9587 .5203 -.3404 .6812 .5188 .5865 -.0269 11 LYS 11 -.5771 -2.9005 999.9900 -.4035 .7460 -.7077 .4898 .1530 .2933 -.4137 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5436 -.3814 .0040 .2466 13 PHE 13 .0900 -1.3471 999.9900 999.9900 .7573 -.1666 .6771 .1067 .3443 .0568 14 ILE 14 -.1408 -1.9342 999.9900 999.9900 .6034 -.4905 .6524 .0378 .2939 -.1563 15 SER 15 .4640 999.9900 -.7153 999.9900 .6705 .1397 .6743 .5300 .5901 .3247 16 GLU 16 -.2326 -1.6501 999.9900 .3501 .6899 -.2107 .6691 .5186 .5813 .0575 17 LYS 17 -.6960 -.5094 999.9900 -.4035 .7460 -.2533 .6810 .1480 .3701 -.0625 18 SER 18 -.3100 999.9900 -.7153 999.9900 .6705 -.1183 .6698 .5273 .5867 .1685 19 SER 19 .6980 999.9900 -.7153 999.9900 .6705 .2177 .6780 .5314 .5925 .3725 20 LYS 20 -3.5196 -1.8181 999.9900 -.4035 .7460 -1.0797 .6769 .1635 .3774 -.6512 21 SER 21 -.4961 999.9900 .6576 999.9900 .6705 .2774 .6738 .5294 .5896 .4071 22 LEU 22 -.6154 -2.3037 999.9900 999.9900 .9565 -.6542 .6810 .1598 .3769 -.2244 23 GLU 23 -.4497 -1.9198 999.9900 .3501 .6899 -.3324 .6718 .5263 .5869 -.0219 24 ILE 24 .2593 -.1188 999.9900 999.9900 .6034 .2479 .4641 .0535 .2246 .2523 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5413 -.3824 .0025 .1551 26 LEU 26 .4996 -2.9612 999.9900 999.9900 .9565 -.5017 .6844 .1468 .3708 -.1348 27 GLY 27 .9829 999.9900 999.9900 999.9900 .7883 .8856 .5696 .4685 .5135 .7023 28 PHE 28 1.2230 -.1118 999.9900 999.9900 .7573 .6228 .6669 .1088 .3413 .5288 29 ASN 29 1.3908 -.3237 999.9900 999.9900 .7518 .6063 .6835 .3905 .5126 .5786 30 GLU 30 .0468 -1.5476 999.9900 1.1588 .6899 .0870 .6747 .5199 .5844 .2571 31 TYR 31 -.0710 -4.1972 999.9900 999.9900 .5630 -1.2351 .6736 -.1784 .1766 -.6420 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4964 .1039 .2674 -.5500 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5422 -.3753 .0070 .2477 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4715 .3337 .3911 .2769 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5366 -.3804 .0016 .2564 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4781 .0904 .2519 -.2183 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5472 -.3717 .0112 .2032 38 ILE 38 -1.3252 -2.2551 999.9900 999.9900 .6034 -.9923 .6576 .0478 .3019 -.4543 39 THR 39 -.5707 999.9900 -.8810 999.9900 .4476 -.3347 .6602 -.2638 .1212 -.1216 40 VAL 40 -.0582 999.9900 -.2457 999.9900 .7810 .1590 .6485 .1305 .3463 .2512 41 ASP 41 -1.4736 -.5463 999.9900 999.9900 .8104 -.4032 .6763 .3833 .5054 -.0300 42 LEU 42 -.0536 .3561 999.9900 999.9900 .9565 .4197 .6742 .1613 .3750 .4189 43 LEU 43 .0762 -2.9612 999.9900 999.9900 .9565 -.6428 .6769 .1567 .3735 -.2190 44 ASP 44 -.8891 -1.7105 999.9900 999.9900 .8104 -.5964 .6810 .3879 .5100 -.1440 45 TYR 45 -3.6999 -1.3952 999.9900 999.9900 .5630 -1.5107 .6764 -.1898 .1711 -.8091 46 SER 46 -2.3021 999.9900 -.7153 999.9900 .6705 -.7823 .6809 .5320 .5940 -.2268 47 GLY 47 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5910 .4672 .5222 -.0244 48 ARG 48 -.3214 -.4990 999.9900 .1593 .8581 .0713 .6763 .5190 .5846 .2217 49 SER 49 -.2454 999.9900 .3727 999.9900 .6705 .2659 .6672 .5281 .5861 .3986 50 TRP 50 -.0034 .0906 999.9900 999.9900 .9378 .3416 .6807 .1957 .3978 .3803 51 THR 51 .0466 999.9900 .0483 999.9900 .4476 .1808 .6554 -.2617 .1204 .1872 52 VAL 52 -.0145 999.9900 -1.0788 999.9900 .7810 -.1041 .6540 .1285 .3474 .0941 53 ARG 53 -.5160 -2.3766 999.9900 .5548 .8581 -.1850 .6807 .5141 .5835 .0386 54 MET 54 -.2651 -.4373 999.9900 .9587 .5203 .1941 .6767 .5121 .5806 .3276 55 LYS 55 -.6340 -1.6955 999.9900 -.4035 .7460 -.4781 .6809 .1682 .3818 -.2202 56 LYS 56 -.3543 -1.0793 999.9900 -.4035 .7460 -.2989 .6720 .1614 .3741 -.0945 57 ARG 57 -1.4318 -.9348 999.9900 .1593 .8581 -.2380 .6839 .5334 .5961 .0039 58 GLY 58 -1.4779 999.9900 999.9900 999.9900 .7883 -.3448 .5773 .4671 .5161 .0887 59 GLU 59 -.6726 -2.8418 999.9900 .3501 .6899 -.6186 .6744 .5166 .5824 -.2139 60 LYS 60 -.8956 -.4196 999.9900 -.0770 .7460 -.1446 .6737 .1676 .3785 .0169 61 VAL 61 .0764 999.9900 -1.0788 999.9900 .7810 -.0738 .6515 .1240 .3438 .1108 62 PHE 62 -.3916 -.6014 999.9900 999.9900 .7573 -.0786 .6711 .1002 .3381 .1071 63 LEU 63 -.5127 -1.4497 999.9900 999.9900 .9565 -.3353 .6779 .1539 .3723 -.0348 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6494 -.2574 .1204 -.8496 65 VAL 65 -1.2071 999.9900 -.0276 999.9900 .7810 -.1512 .6509 .1271 .3454 .0649 66 GLY 66 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5950 .4787 .5304 -.2776 67 TRP 67 -.3273 -3.3859 999.9900 999.9900 .9378 -.9251 .6752 .1954 .3953 -.3810 68 GLU 68 .8733 -2.8418 999.9900 -1.0323 .6899 -.5777 .6738 .5146 .5809 -.1871 69 ASN 69 1.1272 .9797 999.9900 999.9900 .7518 .9529 .6770 .3729 .4996 .7817 70 PHE 70 .8041 -.4306 999.9900 999.9900 .7573 .3770 .6691 .0980 .3360 .3796 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6596 .1339 .3529 .2958 72 LYS 72 .6780 -2.9005 999.9900 .5131 .7460 -.0900 .6819 .1546 .3743 .0552 73 ASP 73 .9921 -2.1980 999.9900 999.9900 .8104 -.1318 .6840 .3954 .5157 .1368 74 ASN 74 .3666 -.3904 999.9900 999.9900 .7518 .2427 .6785 .3862 .5080 .3585 75 ASN 75 -.6067 -.0024 999.9900 999.9900 .7518 .0476 .6748 .3866 .5067 .2408 76 LEU 76 -.3855 .5521 999.9900 999.9900 .9565 .3744 .6755 .1536 .3710 .3904 77 GLU 77 -1.2977 -2.8418 999.9900 .3501 .6899 -.7749 .6764 .5188 .5845 -.3174 78 ASP 78 -.9954 -1.1646 999.9900 999.9900 .8104 -.4499 .6755 .3766 .5011 -.0595 79 GLY 79 -2.2927 999.9900 999.9900 999.9900 .7883 -.7522 .5847 .4741 .5232 -.1114 80 LYS 80 -.7292 -.7918 999.9900 -.4035 .7460 -.3164 .6759 .1599 .3749 -.1066 81 TYR 81 .0868 .4830 999.9900 999.9900 .5630 .3776 .6729 -.1732 .1794 .3265 82 LEU 82 -.6392 -3.3760 999.9900 999.9900 .9565 -1.0196 .6765 .1671 .3794 -.4430 83 GLN 83 -.2750 .1268 999.9900 1.3059 .5113 .4172 .6758 .5257 .5882 .4784 84 PHE 84 -.2457 -4.3038 999.9900 999.9900 .7573 -1.2641 .6748 .1069 .3435 -.6021 85 ILE 85 .3543 -2.2551 999.9900 999.9900 .6034 -.4325 .6571 .0495 .3027 -.1182 86 TYR 86 .0406 -2.3638 999.9900 999.9900 .5630 -.5868 .6713 -.1817 .1737 -.2541 87 ASP 87 -1.5723 -1.6521 999.9900 999.9900 .8104 -.8047 .6769 .3923 .5109 -.2690 88 ARG 88 -1.7561 -1.0788 999.9900 .6901 .8581 -.1193 .6768 .5161 .5831 .0852 89 ASP 89 -2.3854 -1.6521 999.9900 999.9900 .8104 -1.0757 .6824 .3790 .5054 -.4331 90 ARG 90 -1.6758 .0684 999.9900 .1593 .8581 -.0861 .6754 .5201 .5848 .1093 91 THR 91 -.0150 999.9900 -.8810 999.9900 .4476 -.1495 .6545 -.2550 .1240 -.0098 92 PHE 92 -.0970 -2.3327 999.9900 999.9900 .7573 -.5575 .6805 .1053 .3450 -.1773 93 TYR 93 .2641 -1.3246 999.9900 999.9900 .5630 -.1658 .6777 -.1835 .1753 -.0007 94 VAL 94 -.3909 999.9900 -1.0788 999.9900 .7810 -.2295 .6557 .1252 .3462 .0184 95 ILE 95 -1.5441 .9074 999.9900 999.9900 .6034 -.0111 .6610 .0387 .2980 .1333 96 ILE 96 .0813 -.8802 999.9900 999.9900 .6034 -.0651 .6513 .0398 .2946 .0991 97 TYR 97 -.6832 .2608 999.9900 999.9900 .5630 .0468 .6720 -.2000 .1633 .1225 98 GLY 98 -.6468 999.9900 999.9900 999.9900 .7883 .0708 .5800 .4699 .5188 .2979 99 HIS 99 -3.0884 -2.4183 999.9900 999.9900 .6686 -1.6127 .6788 .3221 .4707 -.7675 100 ASN 100 -.8722 -2.3357 999.9900 999.9900 .7518 -.8187 .6757 .3837 .5054 -.2793 101 MET 101 -.3815 -1.1990 999.9900 1.7963 .5203 .1840 .6738 .5071 .5766 .3195 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6828 .2452 .4327 .3525 Means: -.5904 -1.4124 -.4757 .2215 .7095 -.2599 .6511 .2121 .3958 .0062 2.00 analyzed_9