1 MET 1 999.9900 -.4373 999.9900 .9587 .5203 .3472 .6711 .5028 .5793 .4431 2 ALA 2 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6689 .3192 .4649 -.3337 3 ASP 3 -.3633 -2.6388 999.9900 999.9900 .8104 -.7306 .6794 .3890 .5100 -.2247 4 THR 4 -.3846 999.9900 -.8810 999.9900 .4476 -.2727 .6599 -.2608 .1228 -.0838 5 GLY 5 -.0207 999.9900 999.9900 999.9900 .7883 .3838 .5921 .4722 .5255 .4580 6 GLU 6 -3.2255 -.8493 999.9900 -1.0323 .6899 -1.1043 .6812 .5228 .5888 -.5356 7 VAL 7 -.3161 999.9900 -1.0788 999.9900 .7810 -.2046 .6563 .1345 .3519 .0354 8 GLN 8 -.4306 -2.6982 999.9900 1.3059 .5113 -.3279 .6758 .5219 .5860 -.0190 9 PHE 9 -.6363 .5389 999.9900 999.9900 .7573 .2200 .6757 .0852 .3313 .2842 10 MET 10 -.8637 -.2630 999.9900 .9587 .5203 .0881 .6715 .5215 .5840 .2575 11 LYS 11 -.6340 -2.9005 999.9900 -.4035 .7460 -.7191 .4926 .1563 .2964 -.4209 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5424 -.3906 -.0019 .2440 13 PHE 13 .0900 -4.3038 999.9900 999.9900 .7573 -1.1522 .6695 .0944 .3340 -.5385 14 ILE 14 .1962 -.9348 999.9900 999.9900 .6034 -.0451 .6534 .0332 .2916 .1103 15 SER 15 .4640 999.9900 -.7153 999.9900 .6705 .1397 .6760 .5308 .5913 .3252 16 GLU 16 .0765 -2.3808 999.9900 -1.0323 .6899 -.6617 .6788 .5292 .5915 -.2398 17 LYS 17 -1.4447 -1.8181 999.9900 -.4035 .7460 -.6648 .6747 .1595 .3742 -.3557 18 SER 18 -.1309 999.9900 .3727 999.9900 .6705 .3041 .6828 .5404 .5998 .4271 19 SER 19 .7360 999.9900 1.0592 999.9900 .6705 .8219 .6793 .5354 .5954 .7361 20 LYS 20 -3.5196 -1.2293 999.9900 -.4035 .7460 -.9620 .6794 .1562 .3742 -.5678 21 SER 21 .0280 999.9900 .3727 999.9900 .6705 .3571 .6712 .5336 .5910 .4552 22 LEU 22 -.6154 -3.3760 999.9900 999.9900 .9565 -1.0116 .6732 .1592 .3734 -.4405 23 GLU 23 -.3890 -.9574 999.9900 -1.0323 .6899 -.4222 .6806 .5181 .5858 -.0817 24 ILE 24 .2593 -.9493 999.9900 999.9900 .6034 -.0289 .4694 .0400 .2189 .0845 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5319 -.3663 .0080 .1568 26 LEU 26 .8442 -1.7554 999.9900 999.9900 .9565 .0151 .6753 .1543 .3714 .1750 27 GLY 27 .1734 999.9900 999.9900 999.9900 .7883 .4808 .5740 .4672 .5146 .5007 28 PHE 28 -1.7494 -.1636 999.9900 999.9900 .7573 -.3852 .6805 .1101 .3478 -.0730 29 ASN 29 1.3908 -1.5725 999.9900 999.9900 .7518 .1901 .6795 .3856 .5080 .3271 30 GLU 30 .8604 -2.8418 999.9900 1.7325 .6899 .1102 .6798 .5206 .5870 .2736 31 TYR 31 -.3674 -2.4815 999.9900 999.9900 .5630 -.7620 .6810 -.1712 .1839 -.3552 32 PHE 32 -1.7494 .6387 999.9900 999.9900 .7573 -.1178 .4784 .1034 .2597 .0457 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5364 -.3781 .0029 .2456 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4782 .3125 .3815 .2733 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5401 -.3657 .0117 .2610 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4916 .1105 .2693 -.2115 37 PRO 37 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5409 -.3905 -.0024 .2549 38 ILE 38 -1.4718 -.4959 999.9900 999.9900 .6034 -.4548 .6550 .0501 .3021 -.1318 39 THR 39 -.5585 999.9900 -.8810 999.9900 .4476 -.3307 .6554 -.2601 .1214 -.1193 40 VAL 40 -.0463 999.9900 .8055 999.9900 .7810 .5134 .6510 .1151 .3384 .4613 41 ASP 41 -.6569 -.0958 999.9900 999.9900 .8104 .0192 .6777 .3833 .5060 .2237 42 LEU 42 -.2443 -.3814 999.9900 999.9900 .9565 .1103 .6777 .1575 .3743 .2332 43 LEU 43 .0762 -3.3760 999.9900 999.9900 .9565 -.7811 .6765 .1566 .3732 -.3020 44 ASP 44 -1.5212 -3.1847 999.9900 999.9900 .8104 -1.2985 .6703 .3754 .4983 -.5700 45 TYR 45 -3.6999 -4.1972 999.9900 999.9900 .5630 -2.4447 .6795 -.1720 .1828 -1.3653 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6812 .5368 .5970 -.5173 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5932 .4797 .5302 -.1492 48 ARG 48 -.5733 -1.5080 999.9900 .1593 .8581 -.1809 .6764 .5155 .5825 .0410 49 SER 49 .0374 999.9900 -.0289 999.9900 .6705 .2264 .6757 .5217 .5859 .3753 50 TRP 50 -.1951 -.7344 999.9900 999.9900 .9378 .0028 .6784 .1977 .3980 .1769 51 THR 51 .0466 999.9900 -.2947 999.9900 .4476 .0665 .6571 -.2555 .1247 .1202 52 VAL 52 -.1853 999.9900 -.2457 999.9900 .7810 .1167 .6599 .1179 .3437 .2256 53 ARG 53 -.5160 -2.8571 999.9900 .1593 .8581 -.4393 .6744 .5183 .5834 -.1434 54 MET 54 -.6588 .1642 999.9900 .9587 .5203 .2461 .6796 .5111 .5813 .3625 55 LYS 55 -.2978 .0952 999.9900 -.4035 .7460 -.0527 .6795 .1573 .3749 .0819 56 LYS 56 -.1765 -1.6955 999.9900 -.0397 .7460 -.2411 .6743 .1656 .3776 -.0522 57 ARG 57 -.7879 -1.0788 999.9900 .6901 .8581 .0743 .6717 .5199 .5831 .2233 58 GLY 58 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5838 .4716 .5215 -.1536 59 GLU 59 -1.0162 -.9194 999.9900 -1.0323 .6899 -.5695 .6780 .5177 .5845 -.1804 60 LYS 60 -.1867 -.4541 999.9900 -.0397 .7460 .0051 .6728 .1461 .3656 .1207 61 VAL 61 .3116 999.9900 .8662 999.9900 .7810 .6529 .6579 .1289 .3493 .5491 62 PHE 62 -.3916 -3.6820 999.9900 999.9900 .7573 -1.1054 .6805 .1063 .3455 -.5059 63 LEU 63 -.7582 -3.3760 999.9900 999.9900 .9565 -1.0592 .6767 .1495 .3692 -.4703 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6525 -.2589 .1209 -.8493 65 VAL 65 -1.2071 999.9900 -.2457 999.9900 .7810 -.2239 .6519 .1163 .3395 .0193 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5691 .4684 .5131 -.1581 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6744 .1856 .3893 -.4561 68 GLU 68 1.0761 -.9977 999.9900 .3501 .6899 .2796 .6711 .5168 .5811 .3844 69 ASN 69 1.1117 .3007 999.9900 999.9900 .7518 .7214 .6762 .3760 .5011 .6433 70 PHE 70 .8041 -1.6624 999.9900 999.9900 .7573 -.0336 .6765 .1046 .3429 .1360 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6575 .1187 .3432 .2924 72 LYS 72 .6780 -.8217 999.9900 -.0397 .7460 .1046 .6761 .1577 .3737 .1938 73 ASP 73 .9921 -2.1980 999.9900 999.9900 .8104 -.1318 .6755 .3856 .5064 .1331 74 ASN 74 .2400 -.2921 999.9900 999.9900 .7518 .2333 .6818 .3861 .5093 .3536 75 ASN 75 -2.1824 -.2320 999.9900 999.9900 .7518 -.5542 .6744 .3833 .5046 -.1210 76 LEU 76 -1.6816 -2.1315 999.9900 999.9900 .9565 -.9522 .6807 .1614 .3777 -.4029 77 GLU 77 -1.3743 -1.3804 999.9900 -1.0323 .6899 -.7743 .6776 .5154 .5830 -.3173 78 ASP 78 -1.5212 .3723 999.9900 999.9900 .8104 -.1128 .6814 .3719 .5009 .1430 79 GLY 79 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5861 .4732 .5234 -.2812 80 LYS 80 -.5681 -.3555 999.9900 -.0397 .7460 -.0514 .6718 .1611 .3739 .0822 81 TYR 81 -.1271 -.9671 999.9900 999.9900 .5630 -.1771 .6756 -.1752 .1793 -.0062 82 LEU 82 -.6392 -2.1315 999.9900 999.9900 .9565 -.6048 .6760 .1467 .3672 -.1983 83 GLN 83 -.1966 -2.2325 999.9900 1.3059 .5113 -.1530 .6782 .5307 .5921 .0995 84 PHE 84 -.2457 -3.6820 999.9900 999.9900 .7573 -1.0568 .6745 .1105 .3455 -.4771 85 ILE 85 .4877 -1.9342 999.9900 999.9900 .6034 -.2810 .6563 .0343 .2935 -.0305 86 TYR 86 .3981 -2.0063 999.9900 999.9900 .5630 -.3484 .6792 -.1910 .1716 -.1114 87 ASP 87 -.7471 -.4551 999.9900 999.9900 .8104 -.1306 .6722 .3745 .4986 .1310 88 ARG 88 -1.2223 -2.8571 999.9900 .6901 .8581 -.3682 .6741 .5150 .5813 -.0932 89 ASP 89 -2.3854 -1.1646 999.9900 999.9900 .8104 -.9132 .6803 .3955 .5142 -.3327 90 ARG 90 -1.6758 -1.1946 999.9900 .6901 .8581 -.1264 .6707 .5167 .5809 .0793 91 THR 91 .3363 999.9900 -.8810 999.9900 .4476 -.0324 .6562 -.2479 .1288 .0622 92 PHE 92 .1097 -1.3145 999.9900 999.9900 .7573 -.1492 .6755 .0961 .3375 .0648 93 TYR 93 .0214 -1.3592 999.9900 999.9900 .5630 -.2583 .6698 -.1731 .1781 -.0556 94 VAL 94 -.3909 999.9900 .8662 999.9900 .7810 .4188 .6592 .1162 .3424 .4063 95 ILE 95 -.9405 -.9795 999.9900 999.9900 .6034 -.4389 .6578 .0457 .3007 -.1226 96 ILE 96 .3408 -.6744 999.9900 999.9900 .6034 .0899 .6535 .0301 .2898 .1907 97 TYR 97 .6005 -.7135 999.9900 999.9900 .5630 .1500 .6765 -.1683 .1837 .1916 98 GLY 98 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5830 .4723 .5215 -.4107 99 HIS 99 -3.0884 -3.1083 999.9900 999.9900 .6686 -1.8427 .6744 .3225 .4691 -.9062 100 ASN 100 -1.9210 -2.3357 999.9900 999.9900 .7518 -1.1683 .6746 .3786 .5019 -.4903 101 MET 101 -2.2339 -2.5481 999.9900 .9587 .5203 -.8258 .6781 .5109 .5806 -.3523 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6777 .2416 .4285 .3497 Means: -.6727 -1.5435 -.1819 .1179 .7095 -.3078 .6511 .2112 .3953 -.0236 2.00 analyzed_11