1 MET 1 999.9900 .5156 999.9900 .9587 .5203 .6649 .6734 .5110 .5848 .6358 2 ALA 2 -1.6032 999.9900 999.9900 999.9900 .7458 -.4287 .6710 .3217 .4672 .0338 3 ASP 3 -3.3417 -1.3712 999.9900 999.9900 .8104 -1.3008 .6796 .3790 .5042 -.5688 4 THR 4 -.6608 999.9900 -.2947 999.9900 .4476 -.1693 .6567 -.2638 .1197 -.0230 5 GLY 5 -.1247 999.9900 999.9900 999.9900 .7883 .3318 .5837 .4720 .5217 .4298 6 GLU 6 -1.7894 -1.9198 999.9900 1.1588 .6899 -.4651 .6749 .5254 .5877 -.1100 7 VAL 7 -.0463 999.9900 -1.0788 999.9900 .7810 -.1147 .6575 .1243 .3465 .0876 8 GLN 8 -.3535 .2203 999.9900 1.3059 .5113 .4210 .6761 .5189 .5844 .4798 9 PHE 9 -.0559 .7639 999.9900 999.9900 .7573 .4884 .6821 .0969 .3407 .4489 10 MET 10 -.2651 -1.3058 999.9900 .9587 .5203 -.0230 .6792 .5153 .5836 .1838 11 LYS 11 -1.0774 -1.8181 999.9900 -.0397 .7460 -.4458 .4996 .1645 .3041 -.2236 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5434 -.3870 .0006 .2451 13 PHE 13 -.0400 -3.6820 999.9900 999.9900 .7573 -.9882 .6808 .0920 .3374 -.4384 14 ILE 14 -.0918 -.6929 999.9900 999.9900 .6034 -.0604 .6563 .0528 .3043 .1056 15 SER 15 .1386 999.9900 .3727 999.9900 .6705 .3940 .6726 .5360 .5929 .4781 16 GLU 16 .8171 -.8493 999.9900 -1.0323 .6899 -.0937 .6761 .5174 .5835 .1365 17 LYS 17 -1.4779 -1.2293 999.9900 -.4035 .7460 -.5537 .6764 .1592 .3747 -.2761 18 SER 18 .1386 999.9900 -.0289 999.9900 .6705 .2601 .6816 .5421 .6002 .4008 19 SER 19 .1589 999.9900 -.7153 999.9900 .6705 .0380 .6815 .5318 .5942 .2655 20 LYS 20 -2.7709 -.9566 999.9900 -.0397 .7460 -.6122 .6806 .1416 .3662 -.3198 21 SER 21 -.3889 999.9900 -.7153 999.9900 .6705 -.1446 .6798 .5314 .5932 .1555 22 LEU 22 -.2022 -3.3760 999.9900 999.9900 .9565 -.8739 .6710 .1630 .3747 -.3575 23 GLU 23 -.9070 -2.8418 999.9900 -1.0323 .6899 -1.0228 .6767 .5223 .5866 -.4821 24 ILE 24 -.1408 -.1188 999.9900 999.9900 .6034 .1146 .4680 .0375 .2169 .1699 25 PRO 25 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5434 -.3768 .0066 .2477 26 LEU 26 .0133 -3.3760 999.9900 999.9900 .9565 -.8020 .6798 .1630 .3783 -.3127 27 GLY 27 -.3460 999.9900 999.9900 999.9900 .7883 .2211 .5863 .4651 .5190 .3734 28 PHE 28 -1.3242 -1.6624 999.9900 999.9900 .7573 -.7431 .6741 .1150 .3480 -.2880 29 ASN 29 .6990 -.7732 999.9900 999.9900 .7518 .2259 .6779 .3899 .5099 .3491 30 GLU 30 -.4919 .0559 999.9900 -1.0323 .6899 -.1946 .6663 .5178 .5797 .0676 31 TYR 31 .3338 -1.2593 999.9900 999.9900 .5630 -.1208 .6761 -.1641 .1860 .0299 32 PHE 32 -3.6149 -.5729 999.9900 999.9900 .7573 -1.1435 .4929 .1078 .2682 -.5660 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5527 -.3581 .0214 .2547 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4832 .3239 .3903 .2774 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5325 -.3722 .0047 .2574 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4726 .0991 .2547 -.2176 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5387 -.3646 .0118 .2029 38 ILE 38 -.2490 -2.2551 999.9900 999.9900 .6034 -.6336 .6528 .0547 .3039 -.2387 39 THR 39 -.5585 999.9900 -.8810 999.9900 .4476 -.3307 .6553 -.2534 .1252 -.1180 40 VAL 40 -.0582 999.9900 -.5532 999.9900 .7810 .0565 .6559 .1188 .3426 .1889 41 ASP 41 -1.3478 -2.3194 999.9900 999.9900 .8104 -.9523 .6782 .3879 .5089 -.3581 42 LEU 42 .0291 -1.5262 999.9900 999.9900 .9565 -.1802 .6752 .1501 .3689 .0569 43 LEU 43 -.1196 -1.8410 999.9900 999.9900 .9565 -.3347 .6741 .1566 .3722 -.0347 44 ASP 44 -1.3478 -1.0010 999.9900 999.9900 .8104 -.5128 .6777 .3848 .5069 -.0952 45 TYR 45 -3.6999 .4960 999.9900 999.9900 .5630 -.8803 .6799 -.1647 .1872 -.4251 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6764 .5362 .5946 -.5184 47 GLY 47 -1.8567 999.9900 999.9900 999.9900 .7883 -.5342 .5890 .4765 .5265 -.0007 48 ARG 48 -.3796 -1.0274 999.9900 .1593 .8581 -.0460 .6736 .5225 .5854 .1380 49 SER 49 -1.0548 999.9900 1.0592 999.9900 .6705 .2250 .6769 .5299 .5912 .3764 50 TRP 50 -.0034 -.0877 999.9900 999.9900 .9378 .2822 .6748 .1827 .3877 .3408 51 THR 51 .4171 999.9900 -.2947 999.9900 .4476 .1900 .6538 -.2443 .1299 .1959 52 VAL 52 -.0145 999.9900 .4980 999.9900 .7810 .4215 .6550 .1285 .3478 .4096 53 ARG 53 -.5160 -2.3766 999.9900 .1593 .8581 -.3432 .6776 .5135 .5819 -.0749 54 MET 54 -.1902 .5072 999.9900 .9587 .5203 .4490 .6797 .5211 .5872 .4995 55 LYS 55 -.6340 -2.1617 999.9900 -.4035 .7460 -.5713 .6765 .1476 .3680 -.2904 56 LYS 56 -.3543 -.9566 999.9900 -.4035 .7460 -.2744 .6740 .1566 .3722 -.0773 57 ARG 57 -.9010 -2.8571 999.9900 .1593 .8581 -.5163 .6735 .5129 .5798 -.1993 58 GLY 58 -.5999 999.9900 999.9900 999.9900 .7883 .0942 .5897 .4811 .5294 .3148 59 GLU 59 -.9196 -1.4588 999.9900 1.1588 .6899 -.1324 .6791 .5220 .5874 .1119 60 LYS 60 -.4999 -1.5918 999.9900 -.4035 .7460 -.4305 .6760 .1440 .3657 -.1904 61 VAL 61 -.0463 999.9900 -1.0788 999.9900 .7810 -.1147 .6603 .1117 .3403 .0856 62 PHE 62 -.1316 .0967 999.9900 999.9900 .7573 .2408 .6761 .0854 .3315 .2968 63 LEU 63 -.7582 -1.5262 999.9900 999.9900 .9565 -.4426 .6790 .1503 .3706 -.0997 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6532 -.2452 .1291 -.8464 65 VAL 65 -1.2071 999.9900 .9224 999.9900 .7810 .1654 .6632 .1248 .3491 .2569 66 GLY 66 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5923 .4845 .5324 -.2016 67 TRP 67 .2222 -3.3859 999.9900 999.9900 .9378 -.7419 .6740 .1946 .3943 -.2714 68 GLU 68 .6116 .0559 999.9900 -1.0323 .6899 .0813 .6752 .5183 .5837 .2531 69 ASN 69 1.1117 -.1227 999.9900 999.9900 .7518 .5803 .6729 .3797 .5019 .5587 70 PHE 70 .8041 .4845 999.9900 999.9900 .7573 .6820 .6712 .1052 .3411 .5645 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6632 .1270 .3504 .2952 72 LYS 72 .3654 -2.9005 999.9900 -.4035 .7460 -.5192 .6725 .1553 .3708 -.2526 73 ASP 73 .9921 -3.7306 999.9900 999.9900 .8104 -.6427 .6756 .3792 .5027 -.1746 74 ASN 74 -.1320 -3.3254 999.9900 999.9900 .7518 -.9019 .6811 .3937 .5135 -.3262 75 ASN 75 -2.5793 .2340 999.9900 999.9900 .7518 -.5312 .6703 .3813 .5017 -.1084 76 LEU 76 -2.5767 -2.1315 999.9900 999.9900 .9565 -1.2506 .6785 .1696 .3817 -.5807 77 GLU 77 -2.1524 -.7564 999.9900 .3501 .6899 -.4672 .6773 .5223 .5869 -.1115 78 ASP 78 -1.3872 -.1440 999.9900 999.9900 .8104 -.2403 .6773 .3732 .4999 .0659 79 GLY 79 -1.8567 999.9900 999.9900 999.9900 .7883 -.5342 .5782 .4717 .5190 -.0046 80 LYS 80 -.4529 -1.2293 999.9900 .1140 .7460 -.1416 .6676 .1592 .3710 .0169 81 TYR 81 .4225 .0738 999.9900 999.9900 .5630 .3531 .6756 -.1877 .1720 .3094 82 LEU 82 -.5178 -.9564 999.9900 999.9900 .9565 -.1726 .6726 .1644 .3761 .0638 83 GLN 83 -.4544 -2.2325 999.9900 1.3059 .5113 -.2174 .6691 .5172 .5805 .0528 84 PHE 84 -.2457 -3.0602 999.9900 999.9900 .7573 -.8495 .6758 .1070 .3440 -.3532 85 ILE 85 .3543 -.6929 999.9900 999.9900 .6034 .0883 .6565 .0357 .2943 .1914 86 TYR 86 .4225 -1.1415 999.9900 999.9900 .5630 -.0520 .6670 -.1662 .1810 .0689 87 ASP 87 -3.3417 -2.3194 999.9900 999.9900 .8104 -1.6169 .6799 .3856 .5082 -.7570 88 ARG 88 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .6725 .5112 .5784 -.4891 89 ASP 89 -2.8635 -1.1348 999.9900 999.9900 .8104 -1.0627 .6782 .3858 .5076 -.4248 90 ARG 90 -2.5097 -2.3766 999.9900 .1593 .8581 -.7419 .6748 .5283 .5894 -.3581 91 THR 91 .5084 999.9900 .0483 999.9900 .4476 .3347 .6581 -.2428 .1326 .2839 92 PHE 92 .0766 -.4548 999.9900 999.9900 .7573 .1263 .6761 .1034 .3420 .2317 93 TYR 93 .0686 .8258 999.9900 999.9900 .5630 .4858 .6773 -.1775 .1786 .3914 94 VAL 94 -.9687 999.9900 -1.0788 999.9900 .7810 -.4221 .6538 .1246 .3451 -.0976 95 ILE 95 -.9405 -3.0500 999.9900 999.9900 .6034 -1.1290 .6516 .0471 .2990 -.5377 96 ILE 96 .2593 -2.6526 999.9900 999.9900 .6034 -.5966 .6577 .0559 .3066 -.2153 97 TYR 97 -.5773 -.6967 999.9900 999.9900 .5630 -.2370 .6760 -.1658 .1850 -.0402 98 GLY 98 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5804 .4736 .5211 -.0255 99 HIS 99 -3.0884 -3.1083 999.9900 999.9900 .6686 -1.8427 .6775 .3281 .4737 -.9045 100 ASN 100 -3.4329 -2.0766 999.9900 999.9900 .7518 -1.5859 .6808 .3794 .5050 -.7395 101 MET 101 -.5881 -1.1064 999.9900 .9587 .5203 -.0539 .6748 .5193 .5841 .1631 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6767 .2444 .4297 .3502 Means: -.7501 -1.3770 -.3350 .0670 .7095 -.3113 .6513 .2132 .3966 -.0252 2.00 analyzed_7