1 MET 1 999.9900 -2.0676 999.9900 .9587 .5203 -.1962 .6718 .5056 .5812 .1178 2 ALA 2 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6676 .3158 .4624 -.4339 3 ASP 3 -2.8635 -3.1847 999.9900 999.9900 .8104 -1.7459 .6743 .3803 .5028 -.8366 4 THR 4 -.1023 999.9900 .0483 999.9900 .4476 .1312 .6477 -.2418 .1288 .1599 5 GLY 5 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5776 .4701 .5179 -.4126 6 GLU 6 -3.2255 -.2138 999.9900 .3501 .6899 -.5998 .6785 .5230 .5878 -.1996 7 VAL 7 -.0145 999.9900 -.2457 999.9900 .7810 .1736 .6581 .1057 .3359 .2569 8 GLN 8 -.3535 -.2905 999.9900 1.3059 .5113 .2933 .6751 .5205 .5849 .3948 9 PHE 9 -.9952 -3.3183 999.9900 999.9900 .7573 -1.1854 .6711 .1009 .3385 -.5568 10 MET 10 -.9371 -2.5481 999.9900 .9587 .5203 -.5016 .6745 .5116 .5795 -.1367 11 LYS 11 -.6340 -.4196 999.9900 -.4035 .7460 -.2229 .4917 .1573 .2966 -.0665 12 PRO 12 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5456 -.3719 .0104 .1588 13 PHE 13 -.2255 -4.3038 999.9900 999.9900 .7573 -1.2573 .6825 .0945 .3395 -.5990 14 ILE 14 -.2299 -1.4972 999.9900 999.9900 .6034 -.3746 .6605 .0341 .2951 -.0858 15 SER 15 .6370 999.9900 -.7153 999.9900 .6705 .1974 .6778 .5256 .5890 .3591 16 GLU 16 1.0761 -.8493 999.9900 -1.0323 .6899 -.0289 .6691 .5175 .5807 .1785 17 LYS 17 -2.0221 -1.5918 999.9900 -.4035 .7460 -.7350 .6743 .1504 .3687 -.4072 18 SER 18 .1386 999.9900 -.7153 999.9900 .6705 .0313 .6726 .5275 .5880 .2588 19 SER 19 .1589 999.9900 -.7153 999.9900 .6705 .0380 .6763 .5271 .5893 .2635 20 LYS 20 -3.5196 -1.9682 999.9900 -.0397 .7460 -.9643 .6842 .1584 .3774 -.5684 21 SER 21 .0184 999.9900 -.7153 999.9900 .6705 -.0088 .6764 .5361 .5946 .2372 22 LEU 22 -.3112 -3.3760 999.9900 999.9900 .9565 -.9102 .6788 .1524 .3717 -.3799 23 GLU 23 -.7347 -.6022 999.9900 -1.0323 .6899 -.4198 .6807 .5253 .5900 -.0789 24 ILE 24 .2593 .5533 999.9900 999.9900 .6034 .4720 .4702 .0554 .2283 .3883 25 PRO 25 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5299 -.3904 -.0069 .1943 26 LEU 26 .8475 -2.0611 999.9900 999.9900 .9565 -.0857 .6787 .1477 .3689 .1138 27 GLY 27 -.6152 999.9900 999.9900 999.9900 .7883 .0865 .5740 .4684 .5153 .3039 28 PHE 28 -1.7494 -4.3038 999.9900 999.9900 .7573 -1.7653 .6800 .1152 .3505 -.9001 29 ASN 29 1.1272 -.5409 999.9900 999.9900 .7518 .4460 .6751 .3838 .5052 .4794 30 GLU 30 .0468 -2.1111 999.9900 -1.0323 .6899 -.6017 .6730 .5130 .5797 -.2035 31 TYR 31 .3338 -4.1972 999.9900 999.9900 .5630 -1.1002 .6721 -.1882 .1703 -.5633 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4820 .1049 .2620 -.5526 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5306 -.3572 .0127 .2494 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4695 .3178 .3810 .2724 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5449 -.3608 .0166 .2634 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4904 .1032 .2646 -.2132 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5460 -.3838 .0036 .1999 38 ILE 38 -1.3252 -1.4972 999.9900 999.9900 .6034 -.7397 .6544 .0444 .2986 -.3040 39 THR 39 -.5707 999.9900 -.8810 999.9900 .4476 -.3347 .6595 -.2503 .1288 -.1190 40 VAL 40 -.0582 999.9900 .6672 999.9900 .7810 .4633 .6584 .1194 .3440 .4336 41 ASP 41 -.6569 .9052 999.9900 999.9900 .8104 .3529 .6753 .3718 .4983 .4212 42 LEU 42 -.3571 .0414 999.9900 999.9900 .9565 .2136 .6820 .1637 .3796 .2973 43 LEU 43 .0762 -2.9612 999.9900 999.9900 .9565 -.6428 .6803 .1505 .3712 -.2195 44 ASP 44 -1.5212 -2.4630 999.9900 999.9900 .8104 -1.0579 .6750 .3744 .4996 -.4249 45 TYR 45 -1.6966 -4.1972 999.9900 999.9900 .5630 -1.7770 .6837 -.1746 .1830 -.9644 46 SER 46 -1.9635 999.9900 -.7153 999.9900 .6705 -.6694 .6741 .5248 .5870 -.1619 47 GLY 47 -.7692 999.9900 999.9900 999.9900 .7883 .0095 .5660 .4585 .5063 .2609 48 ARG 48 -.4155 -1.5080 999.9900 .1593 .8581 -.1493 .6760 .5268 .5890 .0652 49 SER 49 .0374 999.9900 -.7153 999.9900 .6705 -.0025 .6789 .5317 .5930 .2406 50 TRP 50 -.2197 -2.2136 999.9900 999.9900 .9378 -.4985 .6783 .1915 .3944 -.1251 51 THR 51 .4171 999.9900 -.8810 999.9900 .4476 -.0055 .6511 -.2456 .1280 .0778 52 VAL 52 -.0582 999.9900 -1.0788 999.9900 .7810 -.1186 .6596 .1183 .3438 .0844 53 ARG 53 -.4063 -1.6149 999.9900 .1593 .8581 -.1689 .6774 .5258 .5890 .0513 54 MET 54 -.1025 -1.1990 999.9900 .9587 .5203 .0444 .6810 .5234 .5891 .2303 55 LYS 55 -.5771 -1.6955 999.9900 -.4035 .7460 -.4667 .6797 .1484 .3698 -.2151 56 LYS 56 -.3543 -.9566 999.9900 -.4035 .7460 -.2744 .6748 .1371 .3611 -.0800 57 ARG 57 -1.4842 -.8928 999.9900 .1593 .8581 -.2400 .6818 .5171 .5857 -.0002 58 GLY 58 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5906 .4764 .5272 -.2041 59 GLU 59 -1.0162 -1.5476 999.9900 1.7325 .6899 -.0353 .6757 .5213 .5856 .1759 60 LYS 60 -.3038 -.8217 999.9900 .4411 .7460 .1006 .6787 .1413 .3652 .1890 61 VAL 61 .0429 999.9900 .8662 999.9900 .7810 .5634 .6584 .1306 .3505 .4958 62 PHE 62 -.3916 -.6459 999.9900 999.9900 .7573 -.0934 .6787 .0998 .3410 .0997 63 LEU 63 -1.0430 -3.3760 999.9900 999.9900 .9565 -1.1541 .6773 .1552 .3727 -.5260 64 THR 64 -4.2065 999.9900 .0483 999.9900 .4476 -1.2369 .6647 -.2600 .1253 -.6612 65 VAL 65 -1.2071 999.9900 .1416 999.9900 .7810 -.0948 .6522 .1152 .3389 .0966 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5824 .4726 .5214 -.1537 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6774 .1895 .3927 -.4547 68 GLU 68 .7157 .3534 999.9900 -1.0323 .6899 .1817 .6783 .5228 .5876 .3213 69 ASN 69 1.1117 -1.8756 999.9900 999.9900 .7518 -.0040 .6736 .3760 .5000 .2075 70 PHE 70 .6259 -.6308 999.9900 999.9900 .7573 .2508 .6799 .0938 .3380 .3052 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6587 .1243 .3470 .2937 72 LYS 72 .6780 -.7357 999.9900 -.4035 .7460 -.0238 .6763 .1548 .3721 .1018 73 ASP 73 .9921 -1.4992 999.9900 999.9900 .8104 .1011 .6769 .3762 .5015 .2713 74 ASN 74 .2400 -1.4522 999.9900 999.9900 .7518 -.1534 .6805 .3867 .5091 .1214 75 ASN 75 -3.4329 -.2921 999.9900 999.9900 .7518 -.9910 .6741 .3864 .5063 -.3825 76 LEU 76 -.7369 -2.4128 999.9900 999.9900 .9565 -.7311 .6821 .1470 .3699 -.2728 77 GLU 77 -1.1499 -1.7714 999.9900 -1.0323 .6899 -.8159 .6766 .5237 .5874 -.3439 78 ASP 78 -1.5212 -3.7306 999.9900 999.9900 .8104 -1.4804 .6817 .3859 .5091 -.6748 79 GLY 79 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5876 .4753 .5252 -.4088 80 LYS 80 -.5681 -.7918 999.9900 -.4035 .7460 -.2842 .6730 .1558 .3713 -.0846 81 TYR 81 .4043 -4.1972 999.9900 999.9900 .5630 -1.0767 .6724 -.1918 .1683 -.5499 82 LEU 82 -.4552 -.9564 999.9900 999.9900 .9565 -.1517 .6826 .1466 .3699 .0748 83 GLN 83 -.1966 -2.6982 999.9900 1.3059 .5113 -.2694 .6776 .5158 .5832 .0193 84 PHE 84 -.2457 -4.3038 999.9900 999.9900 .7573 -1.2641 .6714 .0966 .3361 -.6048 85 ILE 85 .4877 -.6929 999.9900 999.9900 .6034 .1328 .6569 .0453 .3002 .2201 86 TYR 86 .3981 -1.2283 999.9900 999.9900 .5630 -.0891 .6724 -.1835 .1731 .0443 87 ASP 87 -1.6875 -1.4542 999.9900 999.9900 .8104 -.7771 .6798 .3880 .5096 -.2527 88 ARG 88 -1.7561 -2.8571 999.9900 .1593 .8581 -.6873 .6778 .5193 .5853 -.3199 89 ASP 89 -2.3854 -.9083 999.9900 999.9900 .8104 -.8277 .6744 .3814 .5035 -.2855 90 ARG 90 -1.7561 -.7140 999.9900 .1593 .8581 -.2587 .6778 .5199 .5857 -.0137 91 THR 91 .3447 999.9900 -.8810 999.9900 .4476 -.0296 .6635 -.2627 .1232 .0624 92 PHE 92 -.0017 .8396 999.9900 999.9900 .7573 .5317 .6777 .1002 .3409 .4746 93 TYR 93 -.0287 .2608 999.9900 999.9900 .5630 .2650 .6795 -.1779 .1794 .2593 94 VAL 94 -.0951 999.9900 -.2457 999.9900 .7810 .1467 .6499 .1259 .3442 .2432 95 ILE 95 -.7007 -2.1272 999.9900 999.9900 .6034 -.7415 .6570 .0397 .2969 -.3056 96 ILE 96 -.2252 -1.9342 999.9900 999.9900 .6034 -.5187 .6609 .0481 .3034 -.1694 97 TYR 97 -.0819 .8376 999.9900 999.9900 .5630 .4395 .6804 -.1696 .1846 .3659 98 GLY 98 -2.0431 999.9900 999.9900 999.9900 .7883 -.6274 .5875 .4708 .5227 -.0491 99 HIS 99 -3.0884 -3.1083 999.9900 999.9900 .6686 -1.8427 .6762 .3135 .4647 -.9077 100 ASN 100 -2.1824 -.0252 999.9900 999.9900 .7518 -.4853 .6773 .3845 .5065 -.0788 101 MET 101 -2.6662 -1.5870 999.9900 .9587 .5203 -.6936 .6794 .5084 .5796 -.2644 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6724 .2268 .4178 .3430 Means: -.7469 -1.6234 -.4044 .0236 .7095 -.3713 .6516 .2102 .3949 -.0628 2.00 analyzed_3