1 ASP 1 999.9900 -3.7306 999.9900 999.9900 .8104 -1.4601 .4947 .3432 .4121 -.5206 2 PRO 2 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .5519 -.3774 .0098 .0819 3 ASN 3 -2.1824 -1.5725 999.9900 999.9900 .7518 -1.0010 .6804 .3798 .5050 -.3886 4 ALA 4 -2.3529 999.9900 999.9900 999.9900 .7458 -.8035 .6635 .3199 .4631 -.1559 5 GLU 5 -3.2255 -1.1358 999.9900 -1.0323 .6899 -1.1760 .6716 .5226 .5847 -.5849 6 PHE 6 -3.6149 -3.6820 999.9900 999.9900 .7573 -2.1798 .6791 .0922 .3368 -1.1536 7 ASP 7 -.3915 -3.7306 999.9900 999.9900 .8104 -1.1039 .4898 .3859 .4292 -.4872 8 PRO 8 -3.6843 999.9900 999.9900 999.9900 .4496 -1.6173 .5488 -.3644 .0161 -.7626 9 ASP 9 -.8696 -2.3194 999.9900 999.9900 .8104 -.7929 .6773 .3821 .5051 -.2639 10 LEU 10 -.4416 -2.3037 999.9900 999.9900 .9565 -.5963 .4917 .1600 .2982 -.2274 11 PRO 11 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5477 -.3600 .0182 .1623 12 GLY 12 -1.7079 999.9900 999.9900 999.9900 .7883 -.4598 .5776 .4702 .5180 .0321 13 GLY 13 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5693 .4613 .5093 -.0313 14 GLY 14 -.8931 999.9900 999.9900 999.9900 .7883 -.0524 .5848 .4739 .5231 .2384 15 LEU 15 -1.5506 -.6635 999.9900 999.9900 .9565 -.4192 .6794 .1555 .3738 -.0845 16 HIS 16 -2.5191 -1.5062 999.9900 999.9900 .6686 -1.1189 .6734 .3186 .4664 -.4729 17 ARG 17 -.5052 -2.8571 999.9900 .6901 .8581 -.2248 .6787 .5179 .5849 .0104 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6748 .3120 .4632 .4137 19 LEU 19 .8442 -2.1315 999.9900 999.9900 .9565 -.1103 .6762 .1461 .3670 .0983 20 ALA 20 .0579 999.9900 999.9900 999.9900 .7458 .4018 .6663 .3221 .4655 .4480 21 CYS 21 -.8048 999.9900 .1296 999.9900 .9108 .0785 .6785 .3219 .4705 .2472 22 ALA 22 -2.1491 999.9900 999.9900 999.9900 .7458 -.7016 .6637 .3125 .4588 -.1068 23 ARG 23 -.7228 -2.3766 999.9900 .1593 .8581 -.3845 .6777 .5112 .5805 -.1048 24 TYR 24 -.1271 -1.3952 999.9900 999.9900 .5630 -.3198 .6725 -.1853 .1721 -.0944 25 PHE 25 -.7849 -.1548 999.9900 999.9900 .7573 -.0608 .6802 .1074 .3460 .1210 26 ILE 26 -.2490 -1.5793 999.9900 999.9900 .6034 -.4083 .6531 .0308 .2901 -.1082 27 ASP 27 -.5288 -2.8653 999.9900 999.9900 .8104 -.8613 .6772 .3776 .5024 -.3058 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6723 .5258 .5868 .2854 29 THR 29 .8449 999.9900 -.8810 999.9900 .4476 .1372 .6555 -.2571 .1231 .1620 30 ASN 30 .6990 -3.3254 999.9900 999.9900 .7518 -.6249 .6765 .3873 .5078 -.1621 31 LEU 31 .2355 -3.3760 999.9900 999.9900 .9565 -.7280 .6722 .1554 .3707 -.2713 32 LYS 32 .7090 -1.6955 999.9900 -.4035 .7460 -.2095 .6847 .1664 .3823 -.0281 33 THR 33 .7717 999.9900 -.8810 999.9900 .4476 .1128 .6588 -.2444 .1319 .1505 34 HIS 34 .9933 -2.4183 999.9900 999.9900 .6686 -.2521 .6707 .3300 .4720 .0489 35 PHE 35 -.5871 -.8889 999.9900 999.9900 .7573 -.2396 .6730 .1013 .3395 .0111 36 ARG 36 .2755 -1.5080 999.9900 .1593 .8581 -.0111 .6786 .5153 .5833 .1626 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6761 .5365 .5947 -.5184 38 LYS 38 1.0429 -1.3520 999.9900 -.4035 .7460 -.0740 .6803 .1589 .3762 .0670 39 ASP 39 1.0815 -3.1847 999.9900 999.9900 .8104 -.4309 .6791 .3815 .5055 -.0464 40 HIS 40 .7721 1.1894 999.9900 999.9900 .6686 .8767 .6779 .3306 .4753 .7277 41 LYS 41 .7090 1.1776 999.9900 .4778 .7460 .7176 .6815 .1500 .3715 .6314 42 LYS 42 .6751 -1.8181 999.9900 .8416 .7460 .2572 .6768 .1435 .3657 .3009 43 ARG 43 .0418 -2.8571 999.9900 .6901 .8581 -.1154 .6750 .5115 .5796 .0871 44 LEU 44 .6296 -3.3760 999.9900 999.9900 .9565 -.5966 .6772 .1553 .3727 -.1915 45 LYS 45 .9451 -1.6955 999.9900 -.4035 .7460 -.1623 .6810 .1556 .3745 .0036 46 GLN 46 .8469 -2.6982 999.9900 1.3059 .5113 -.0085 .6748 .5255 .5877 .1944 47 LEU 47 .8475 -2.9612 999.9900 999.9900 .9565 -.3857 .6804 .1450 .3681 -.0664 48 SER 48 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6709 .5344 .5913 -.5199 49 VAL 49 -3.4930 999.9900 .3968 999.9900 .7810 -.7717 .6546 .1180 .3416 -.3085 50 GLU 50 -3.2255 -1.6501 999.9900 .3501 .6899 -.9589 .4929 .5205 .5090 -.4704 51 PRO 51 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5412 -.3693 .0101 .2603 52 TYR 52 -3.6999 -1.3246 999.9900 999.9900 .5630 -1.4872 .6759 -.1720 .1813 -.7915 53 SER 53 -2.9368 999.9900 1.0592 999.9900 .6705 -.4024 .6797 .5348 .5951 .0015 54 GLN 54 -3.1236 -1.3908 999.9900 1.3059 .5113 -.6743 .6732 .5176 .5824 -.2511 55 GLU 55 -3.2255 -1.2470 999.9900 -1.0323 .6899 -1.2037 .6760 .5156 .5824 -.6039 56 GLU 56 -3.2255 -2.1111 999.9900 -1.0323 .6899 -1.4198 .6778 .5230 .5875 -.7464 57 ALA 57 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6667 .3314 .4711 -.3312 58 GLU 58 -2.3953 -1.9198 999.9900 1.7325 .6899 -.4732 .6738 .5130 .5800 -.1176 59 ARG 59 -.6502 -.8928 999.9900 .1593 .8581 -.0733 .6796 .5242 .5889 .1196 60 ALA 60 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6718 .3196 .4664 -.4318 61 ALA 61 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6681 .3167 .4631 -.3345 62 GLY 62 -1.0150 999.9900 999.9900 999.9900 .7883 -.1133 .5796 .4695 .5184 .2056 63 MET 63 -1.9811 -1.5870 999.9900 .9587 .5203 -.5223 .6745 .5134 .5805 -.1502 64 GLY 64 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5698 .4620 .5099 -.1595 65 SER 65 -2.5541 999.9900 -.7153 999.9900 .6705 -.8663 .6781 .5300 .5917 -.2782 66 TYR 66 -.3521 -3.5861 999.9900 999.9900 .5630 -1.1251 .6771 -.1756 .1797 -.5747 67 VAL 67 999.9900 999.9900 .9747 999.9900 999.9900 .9747 .6397 -.0848 .2257 .5099 Means: -1.0742 -1.9634 -.1758 .2318 .7264 -.4636 .6489 .2580 .4218 -.1071 2.00 analyzed_5