1 MET 1 999.9900 -1.3058 999.9900 .9587 .5203 .0577 .6762 .5106 .5859 .2720 2 THR 2 -.0343 999.9900 -.8810 999.9900 .4476 -.1559 .6564 -.2450 .1306 -.0113 3 GLU 3 -2.8104 -1.7714 999.9900 -1.0323 .6899 -1.2310 .6784 .5271 .5901 -.6198 4 VAL 4 -.7132 999.9900 -.2457 999.9900 .7810 -.0593 .6658 .1312 .3540 .1238 5 TYR 5 .6005 -1.1984 999.9900 999.9900 .5630 -.0117 .6749 -.1938 .1681 .0892 6 ASP 6 -.3726 -1.2276 999.9900 999.9900 .8104 -.2633 .6749 .3832 .5047 .0537 7 LEU 7 -.7230 -3.3760 999.9900 999.9900 .9565 -1.0475 .6779 .1620 .3770 -.4605 8 GLU 8 -.6163 -.0968 999.9900 .3501 .6899 .0817 .6748 .5166 .5826 .2531 9 ILE 9 -.6670 -1.6252 999.9900 999.9900 .6034 -.5629 .6532 .0314 .2905 -.2008 10 THR 10 -1.0285 999.9900 -.8810 999.9900 .4476 -.4873 .6579 -.2575 .1239 -.2123 11 THR 11 -.8088 999.9900 -.8810 999.9900 .4476 -.4141 .6470 -.2555 .1206 -.1701 12 ASN 12 -.6931 -2.0766 999.9900 999.9900 .7518 -.6726 .6809 .3742 .5020 -.1925 13 ALA 13 -.8167 999.9900 999.9900 999.9900 .7458 -.0354 .6654 .3160 .4615 .2276 14 THR 14 .2086 999.9900 .4804 999.9900 .4476 .3788 .6561 -.2565 .1238 .3072 15 ASP 15 -.5406 -2.6388 999.9900 999.9900 .8104 -.7897 .6695 .3750 .4977 -.2649 16 PHE 16 -.9433 .3647 999.9900 999.9900 .7573 .0596 .4825 .1056 .2626 .1534 17 PRO 17 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5349 -.3718 .0060 .2581 18 MET 18 -.6343 -1.1064 999.9900 .9587 .5203 -.0654 .6860 .5224 .5906 .1578 19 GLU 19 -.4497 -2.8418 999.9900 .3501 .6899 -.5629 .6693 .5145 .5790 -.1780 20 LYS 20 -.2978 -1.8181 999.9900 .6906 .7460 .0023 .6797 .1585 .3757 .1214 21 LYS 21 -.2075 .4277 999.9900 .4411 .7460 .3697 .6783 .1549 .3730 .3831 22 TYR 22 .0777 -.3337 999.9900 999.9900 .5630 .1023 .4952 -.1897 .0957 .1225 23 PRO 23 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5479 -.3617 .0173 .2526 24 ALA 24 -.5171 999.9900 999.9900 999.9900 .7458 .1144 .6638 .3273 .4675 .3050 25 GLY 25 -.6968 999.9900 999.9900 999.9900 .7883 .0457 .5819 .4791 .5248 .2881 26 MET 26 -1.0666 -.2892 999.9900 .9587 .5203 .0308 .6713 .5232 .5849 .2196 27 SER 27 -.6561 999.9900 -.7153 999.9900 .6705 -.2336 .6746 .5295 .5900 .1006 28 LEU 28 .2872 -1.9980 999.9900 999.9900 .9565 -.2514 .6772 .1599 .3754 .0166 29 ASN 29 1.1272 -1.5725 999.9900 999.9900 .7518 .1022 .6749 .3894 .5084 .2742 30 ASP 30 1.3227 -1.3712 999.9900 999.9900 .8104 .2540 .6783 .3800 .5043 .3640 31 LEU 31 .9913 -2.0611 999.9900 999.9900 .9565 -.0378 .6793 .1574 .3749 .1447 32 LYS 32 .7090 -.8530 999.9900 -.4035 .7460 -.0410 .6788 .1554 .3735 .0899 33 LYS 33 1.2214 -2.1617 999.9900 -.4035 .7460 -.2002 .6758 .1608 .3754 -.0235 34 LYS 34 1.2214 -1.9682 999.9900 -.4035 .7460 -.1616 .6780 .1576 .3744 .0040 35 LEU 35 -.0169 -1.3818 999.9900 999.9900 .9565 -.1474 .6768 .1563 .3732 .0782 36 GLU 36 .6833 -.6497 999.9900 -1.0323 .6899 -.0772 .6771 .5265 .5893 .1491 37 LEU 37 .8475 -1.7167 999.9900 999.9900 .9565 .0291 .6755 .1636 .3769 .1853 38 VAL 38 -.2954 999.9900 .6672 999.9900 .7810 .3843 .6525 .1261 .3454 .3863 39 VAL 39 -1.0844 999.9900 .4980 999.9900 .7810 .0649 .6656 .1302 .3533 .1981 40 GLY 40 -.1327 999.9900 999.9900 999.9900 .7883 .3278 .5689 .4629 .5100 .4219 41 THR 41 -1.4183 999.9900 -.8810 999.9900 .4476 -.6172 .6564 -.2574 .1234 -.2905 42 THR 42 -.1094 999.9900 -.8810 999.9900 .4476 -.1809 .6569 -.2355 .1364 -.0243 43 VAL 43 -1.0844 999.9900 -.2457 999.9900 .7810 -.1830 .6585 .1213 .3451 .0462 44 ASP 44 -.2149 -3.7306 999.9900 999.9900 .8104 -1.0450 .6785 .3767 .5024 -.4160 45 SER 45 -.8292 999.9900 -.7153 999.9900 .6705 -.2913 .6774 .5331 .5932 .0673 46 MET 46 -.4857 -.7184 999.9900 .9587 .5203 .0687 .6804 .5141 .5834 .2449 47 ARG 47 -.4636 -1.8960 999.9900 .1593 .8581 -.2366 .6779 .5176 .5844 .0018 48 ILE 48 -.1535 -1.6252 999.9900 999.9900 .6034 -.3918 .6651 .0481 .3051 -.0924 49 GLN 49 -.2750 -1.9601 999.9900 1.3059 .5113 -.1045 .6749 .5244 .5871 .1302 50 LEU 50 -.0536 -2.5464 999.9900 999.9900 .9565 -.5478 .6710 .1621 .3741 -.1621 51 PHE 51 -.0168 -2.4384 999.9900 999.9900 .7573 -.5659 .6763 .1148 .3487 -.1814 52 ASP 52 -.8507 -1.0785 999.9900 999.9900 .8104 -.3730 .6761 .3818 .5044 -.0122 53 GLY 53 .2047 999.9900 999.9900 999.9900 .7883 .4965 .5808 .4636 .5157 .5094 54 ASP 54 -2.5838 -2.8653 999.9900 999.9900 .8104 -1.5463 .6792 .3857 .5080 -.7148 55 ASP 55 -3.3417 -3.1847 999.9900 999.9900 .8104 -1.9053 .6689 .3791 .4998 -.9336 56 GLN 56 -2.0516 -1.7668 999.9900 1.3059 .5113 -.5003 .6805 .5174 .5853 -.1339 57 LEU 57 -.2181 -3.3760 999.9900 999.9900 .9565 -.8792 .6738 .1441 .3648 -.3639 58 LYS 58 -1.1367 -1.9682 999.9900 -.4035 .7460 -.6332 .6783 .1489 .3695 -.3341 59 GLY 59 -.0934 999.9900 999.9900 999.9900 .7883 .3474 .5813 .4746 .5220 .4377 60 GLU 60 -.6163 -2.3808 999.9900 -1.0323 .6899 -.8349 .6789 .5248 .5890 -.3560 61 LEU 61 -3.7702 -3.3760 999.9900 999.9900 .9565 -2.0632 .6784 .1623 .3773 -1.0698 62 THR 62 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6570 -.2494 .1282 -.8465 63 ASP 63 -.6569 -2.3194 999.9900 999.9900 .8104 -.7220 .6798 .3858 .5083 -.2201 64 GLY 64 -1.1293 999.9900 999.9900 999.9900 .7883 -.1705 .5797 .4718 .5197 .1776 65 ALA 65 -.4914 999.9900 999.9900 999.9900 .7458 .1272 .6719 .3180 .4654 .3111 66 LYS 66 -1.3537 -1.8181 999.9900 .3240 .7460 -.3555 .6845 .1577 .3772 -.1336 67 SER 67 -.1368 999.9900 -.7153 999.9900 .6705 -.0606 .6739 .5337 .5921 .2052 68 LEU 68 .2872 -1.2483 999.9900 999.9900 .9565 -.0015 .6777 .1474 .3684 .1641 69 LYS 69 .6751 -1.9682 999.9900 -.4035 .7460 -.2708 .6791 .1614 .3771 -.0734 70 ASP 70 .6201 -1.7735 999.9900 999.9900 .8104 -.1143 .6769 .3837 .5059 .1435 71 LEU 71 -.2213 -.3814 999.9900 999.9900 .9565 .1179 .6728 .1590 .3731 .2371 72 GLY 72 1.0314 999.9900 999.9900 999.9900 .7883 .9098 .5836 .4693 .5201 .7181 73 VAL 73 -4.3409 999.9900 -.5532 999.9900 .7810 -1.3710 .6582 .1142 .3408 -.6681 74 ARG 74 -2.9267 .0581 999.9900 .1593 .8581 -.3384 .6754 .5186 .5839 -.0711 75 ASP 75 -.1445 -3.7306 999.9900 999.9900 .8104 -1.0215 .6818 .3795 .5055 -.4007 76 GLY 76 1.0529 999.9900 999.9900 999.9900 .7883 .9206 .5887 .4808 .5288 .7277 77 TYR 77 -.3077 -2.7782 999.9900 999.9900 .5630 -.8410 .6769 -.1777 .1784 -.4047 78 ARG 78 -.6502 .4960 999.9900 .1593 .8581 .2045 .6793 .5209 .5869 .3175 79 ILE 79 .0187 -.2003 999.9900 999.9900 .6034 .1406 .6585 .0524 .3049 .2265 80 HIS 80 -.1228 -.1773 999.9900 999.9900 .6686 .1228 .6748 .3186 .4670 .2724 81 ALA 81 -.7688 999.9900 999.9900 999.9900 .7458 -.0115 .6711 .3271 .4704 .2438 82 VAL 82 -1.0844 999.9900 -1.0788 999.9900 .7810 -.4607 .6636 .1208 .3470 -.1195 83 ASP 83 -.6293 -2.8653 999.9900 999.9900 .8104 -.8948 .6767 .3910 .5101 -.3233 84 VAL 84 -1.2342 999.9900 -.5532 999.9900 .7810 -.3354 .6511 .1289 .3465 -.0453 85 THR 85 .1579 999.9900 -.8810 999.9900 .4476 -.0918 .6647 -.2631 .1235 .0252 86 GLY 86 -.9159 999.9900 999.9900 999.9900 .7883 -.0638 .5763 .4808 .5232 .2324 87 GLY 87 -.9638 999.9900 999.9900 999.9900 .7883 -.0878 .5857 .4681 .5204 .2196 88 ASN 88 -.1778 -2.3357 999.9900 999.9900 .7518 -.5872 .6756 .3761 .5009 -.1420 89 GLU 89 -3.2255 -1.1358 999.9900 .3501 .6899 -.8303 .6746 .5183 .5834 -.3548 90 ASP 90 999.9900 -.5059 999.9900 999.9900 999.9900 -.5059 .6776 .3734 .5038 .1817 Means: -.5470 -1.6534 -.5191 .1245 .7218 -.2911 .6573 .2332 .4111 -.0054 2.00 analyzed_17