1 MET 1 999.9900 -2.0676 999.9900 .9587 .5203 -.1962 .6744 .5094 .5844 .1190 2 ALA 2 -2.5451 999.9900 999.9900 999.9900 .7458 -.8997 .6725 .3134 .4631 -.2033 3 ASP 3 -.9091 -2.0928 999.9900 999.9900 .8104 -.7305 .6714 .3829 .5031 -.2274 4 THR 4 -1.3548 999.9900 -.8810 999.9900 .4476 -.5961 .6564 -.2454 .1304 -.2755 5 GLY 5 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5787 .4802 .5240 -.4098 6 GLU 6 -3.2255 -.2138 999.9900 -1.0323 .6899 -.9454 .6693 .5228 .5838 -.4316 7 VAL 7 -.0463 999.9900 -1.0788 999.9900 .7810 -.1147 .6547 .1286 .3478 .0879 8 GLN 8 -1.0957 -2.6982 999.9900 1.3059 .5113 -.4942 .6750 .5186 .5838 -.1305 9 PHE 9 -.4296 .3192 999.9900 999.9900 .7573 .2156 .6831 .1042 .3454 .2868 10 MET 10 -.1025 -2.5481 999.9900 .9587 .5203 -.2929 .6809 .5309 .5934 .0067 11 LYS 11 -.8267 -2.9005 999.9900 -.4035 .7460 -.7577 .4987 .1563 .2990 -.4476 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5476 -.3714 .0115 .2501 13 PHE 13 .0900 -2.5581 999.9900 999.9900 .7573 -.5703 .6789 .0983 .3402 -.1867 14 ILE 14 -.0022 .4743 999.9900 999.9900 .6034 .3585 .6552 .0260 .2882 .3513 15 SER 15 .6370 999.9900 -.7153 999.9900 .6705 .1974 .6795 .5352 .5953 .3614 16 GLU 16 .6833 -.8493 999.9900 -1.0323 .6899 -.1271 .6761 .5232 .5869 .1151 17 LYS 17 -2.0221 -1.5020 999.9900 -.4035 .7460 -.7170 .6771 .1424 .3652 -.3951 18 SER 18 .4640 999.9900 -.7153 999.9900 .6705 .1397 .6729 .5311 .5902 .3246 19 SER 19 .6370 999.9900 -.7153 999.9900 .6705 .1974 .6810 .5371 .5970 .3621 20 LYS 20 -2.2985 -.8858 999.9900 .4778 .7460 -.2965 .6783 .1698 .3817 -.0906 21 SER 21 .0184 999.9900 -.7153 999.9900 .6705 -.0088 .6741 .5293 .5896 .2354 22 LEU 22 -.3112 -3.3760 999.9900 999.9900 .9565 -.9102 .6815 .1593 .3769 -.3780 23 GLU 23 -1.1136 -.4584 999.9900 1.7325 .6899 .2126 .6786 .5188 .5854 .3413 24 ILE 24 -.1408 -1.5368 999.9900 999.9900 .6034 -.3581 .4675 .0415 .2190 -.1130 25 PRO 25 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5477 -.3757 .0090 .2024 26 LEU 26 1.1349 -3.3760 999.9900 999.9900 .9565 -.4282 .6752 .1531 .3706 -.0913 27 GLY 27 .1734 999.9900 999.9900 999.9900 .7039 .4386 .5800 .4739 .5211 .4828 28 PHE 28 .6259 -.8691 999.9900 999.9900 .7573 .1713 .6805 .1078 .3464 .2605 29 ASN 29 1.3908 -.8859 999.9900 999.9900 .7518 .4189 .6802 .3867 .5090 .4647 30 GLU 30 .0468 -1.6501 999.9900 1.7325 .6899 .2048 .6715 .5196 .5829 .3350 31 TYR 31 -.0083 -4.1972 999.9900 999.9900 .5630 -1.2142 .6781 -.1893 .1722 -.6307 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4833 .1122 .2669 -.5509 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5559 -.3557 .0241 .2561 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4737 .3200 .3840 .2740 35 PRO 35 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5343 -.3639 .0103 .2020 36 PHE 36 -1.5081 -4.3038 999.9900 999.9900 .7573 -1.6849 .4828 .1160 .2688 -.8912 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5348 -.3944 -.0072 .1945 38 ILE 38 -.4906 -.7522 999.9900 999.9900 .6034 -.2131 .6629 .0409 .3000 .0129 39 THR 39 -.8088 999.9900 -.8810 999.9900 .4476 -.4141 .6568 -.2619 .1209 -.1695 40 VAL 40 -.0582 999.9900 .8662 999.9900 .7810 .5297 .6606 .1328 .3527 .4765 41 ASP 41 -.9091 -.2599 999.9900 999.9900 .8104 -.1195 .6774 .3905 .5100 .1419 42 LEU 42 .1006 -1.8410 999.9900 999.9900 .9565 -.2613 .6748 .1574 .3730 .0097 43 LEU 43 .0762 -3.3760 999.9900 999.9900 .9565 -.7811 .6777 .1520 .3710 -.3027 44 ASP 44 -1.3105 -2.6388 999.9900 999.9900 .8104 -1.0463 .6794 .3831 .5066 -.4153 45 TYR 45 -2.3553 -2.7782 999.9900 999.9900 .5630 -1.5235 .6732 -.1771 .1772 -.8149 46 SER 46 -3.2405 999.9900 -.0289 999.9900 .6705 -.8663 .6833 .5417 .6007 -.2748 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5766 .4621 .5130 -.1578 48 ARG 48 -.5733 -2.0954 999.9900 .9503 .8581 .0180 .6781 .5192 .5854 .1839 49 SER 49 -.0526 999.9900 1.0592 999.9900 .6705 .5590 .6727 .5193 .5832 .5738 50 TRP 50 -.3273 -1.4740 999.9900 999.9900 .9378 -.2879 .6812 .1940 .3970 .0023 51 THR 51 .4171 999.9900 -.8810 999.9900 .4476 -.0055 .6620 -.2536 .1279 .0784 52 VAL 52 -.0582 999.9900 -1.0788 999.9900 .7810 -.1186 .6611 .1290 .3507 .0868 53 ARG 53 -.5160 -1.6149 999.9900 .1593 .8581 -.1908 .6788 .5150 .5832 .0342 54 MET 54 -.3206 -.7698 999.9900 .9587 .5203 .0972 .6739 .5144 .5808 .2628 55 LYS 55 -.1765 -1.5918 999.9900 -.4035 .7460 -.3659 .6764 .1508 .3698 -.1432 56 LYS 56 -.1765 -.7632 999.9900 -.4035 .7460 -.2001 .6793 .1495 .3703 -.0245 57 ARG 57 -1.7561 -2.0954 999.9900 1.0856 .8581 -.1645 .6680 .5159 .5793 .0517 58 GLY 58 -.5278 999.9900 999.9900 999.9900 .7883 .1302 .5884 .4791 .5277 .3320 59 GLU 59 -1.0162 -2.3808 999.9900 .3501 .6899 -.5893 .6787 .5227 .5877 -.1926 60 LYS 60 -.2075 -2.1617 999.9900 -.0397 .7460 -.3405 .6770 .1579 .3742 -.1240 61 VAL 61 .0429 999.9900 .3968 999.9900 .7810 .4069 .6651 .1162 .3449 .4004 62 PHE 62 -.3916 -1.3810 999.9900 999.9900 .7573 -.3384 .6758 .1094 .3454 -.0460 63 LEU 63 -.2787 -1.9980 999.9900 999.9900 .9565 -.4401 .6790 .1605 .3765 -.0961 64 THR 64 -4.2065 999.9900 .0483 999.9900 .4476 -1.2369 .6561 -.2570 .1234 -.6623 65 VAL 65 -1.2071 999.9900 .9224 999.9900 .7810 .1654 .6619 .1197 .3456 .2556 66 GLY 66 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5966 .4803 .5320 -.2016 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6792 .1907 .3942 -.4541 68 GLU 68 .8733 -2.8418 999.9900 .3501 .6899 -.2321 .6765 .5231 .5870 .0452 69 ASN 69 1.0488 1.1701 999.9900 999.9900 .7518 .9902 .6818 .3848 .5085 .8074 70 PHE 70 .8041 -.1636 999.9900 999.9900 .7573 .4660 .6720 .0932 .3344 .4326 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6579 .1253 .3473 .2938 72 LYS 72 .6780 -.8530 999.9900 -.4035 .7460 -.0472 .6737 .1580 .3728 .0851 73 ASP 73 .9921 -1.9171 999.9900 999.9900 .8104 -.0382 .6766 .3834 .5056 .1891 74 ASN 74 .2737 -2.3357 999.9900 999.9900 .7518 -.4367 .6784 .3919 .5113 -.0480 75 ASN 75 -3.4329 -1.0869 999.9900 999.9900 .7518 -1.2560 .6735 .3758 .4998 -.5438 76 LEU 76 -.3571 -.0645 999.9900 999.9900 .9565 .1783 .6787 .1525 .3718 .2732 77 GLU 77 -1.1499 -1.1358 999.9900 .3501 .6899 -.3114 .6746 .5242 .5869 -.0078 78 ASP 78 -.5899 -1.1646 999.9900 999.9900 .8104 -.3147 .6745 .3896 .5083 .0240 79 GLY 79 -2.1575 999.9900 999.9900 999.9900 .7883 -.6846 .5870 .4688 .5213 -.0784 80 LYS 80 -.7762 .6318 999.9900 .1731 .7460 .1895 .6832 .1553 .3753 .2552 81 TYR 81 .4043 .3463 999.9900 999.9900 .5630 .4379 .6801 -.1765 .1804 .3634 82 LEU 82 -.4552 -2.1315 999.9900 999.9900 .9565 -.5434 .6823 .1555 .3750 -.1585 83 GLN 83 -.1966 .6315 999.9900 1.3059 .5113 .5630 .6772 .5241 .5879 .5756 84 PHE 84 -.2457 -3.6820 999.9900 999.9900 .7573 -1.0568 .6825 .1174 .3529 -.4741 85 ILE 85 .1597 -1.9342 999.9900 999.9900 .6034 -.3904 .6556 .0390 .2959 -.0953 86 TYR 86 .0686 -4.1972 999.9900 999.9900 .5630 -1.1886 .6705 -.1809 .1739 -.6152 87 ASP 87 -1.5723 -.9768 999.9900 999.9900 .8104 -.5796 .6819 .3887 .5109 -.1336 88 ARG 88 -1.4842 -1.8960 999.9900 .1593 .8581 -.4407 .6694 .5175 .5808 -.1452 89 ASP 89 -2.3854 -1.8420 999.9900 999.9900 .8104 -1.1390 .6794 .3778 .5035 -.4720 90 ARG 90 -1.6758 -2.8571 999.9900 1.6084 .8581 -.0916 .6749 .5143 .5812 .1044 91 THR 91 .3447 999.9900 .0483 999.9900 .4476 .2802 .6616 -.2480 .1310 .2508 92 PHE 92 -.0168 -1.1403 999.9900 999.9900 .7573 -.1333 .6808 .1120 .3490 .0786 93 TYR 93 .0500 .5339 999.9900 999.9900 .5630 .3823 .6787 -.1711 .1830 .3309 94 VAL 94 .1037 999.9900 .1416 999.9900 .7810 .3421 .6537 .1187 .3416 .3597 95 ILE 95 -.9405 -.6139 999.9900 999.9900 .6034 -.3170 .6605 .0515 .3053 -.0478 96 ILE 96 .2593 -2.0226 999.9900 999.9900 .6034 -.3867 .6549 .0414 .2970 -.0927 97 TYR 97 -.0819 .8258 999.9900 999.9900 .5630 .4356 .6693 -.1667 .1817 .3619 98 GLY 98 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5889 .4790 .5278 -.4076 99 HIS 99 -3.0884 -.4813 999.9900 999.9900 .6686 -.9670 .6805 .3237 .4724 -.3794 100 ASN 100 -.5477 -2.3357 999.9900 999.9900 .7518 -.7105 .6774 .3803 .5041 -.2148 101 MET 101 -2.6662 -2.5481 999.9900 .9587 .5203 -.9338 .6782 .5161 .5836 -.4235 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6779 .2476 .4320 .3517 Means: -.6468 -1.5668 -.2714 .3592 .7087 -.2816 .6524 .2129 .3968 -.0068 2.00 analyzed_5