1 ASP 1 999.9900 -3.1847 999.9900 999.9900 .8104 -1.1871 .4965 .3516 .4174 -.3816 2 PRO 2 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5472 -.3779 .0076 .2597 3 ASN 3 -2.1824 -1.0869 999.9900 999.9900 .7518 -.8392 .6775 .3738 .5004 -.2932 4 ALA 4 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6708 .3251 .4692 -.4307 5 GLU 5 -3.2255 -2.1111 999.9900 -1.0323 .6899 -1.4198 .6778 .5258 .5891 -.7459 6 PHE 6 -3.6149 .3647 999.9900 999.9900 .7573 -.8309 .6792 .1014 .3421 -.3425 7 ASP 7 -.5899 -2.4630 999.9900 999.9900 .8104 -.7475 .4837 .3772 .4216 -.2763 8 PRO 8 -3.6843 999.9900 999.9900 999.9900 .4496 -1.6173 .5478 -.3709 .0119 -.7644 9 ASP 9 .3915 -1.8420 999.9900 999.9900 .8104 -.2134 .6750 .3798 .5028 .0829 10 LEU 10 -.4282 -.1789 999.9900 999.9900 .9565 .1165 .4770 .1555 .2895 .1964 11 PRO 11 -5.1268 999.9900 999.9900 999.9900 .4496 -2.3386 .5503 -.3687 .0142 -1.1239 12 GLY 12 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5739 .4732 .5180 -.4127 13 GLY 13 .5723 999.9900 999.9900 999.9900 .7883 .6803 .5683 .4563 .5061 .5963 14 GLY 14 -1.1609 999.9900 999.9900 999.9900 .7883 -.1863 .5732 .4724 .5172 .1683 15 LEU 15 -1.8089 -.6635 999.9900 999.9900 .9565 -.5053 .6762 .1735 .3830 -.1332 16 HIS 16 -1.0475 -3.1083 999.9900 999.9900 .6686 -1.1624 .6811 .3217 .4715 -.4969 17 ARG 17 -.5052 -2.8571 999.9900 1.0005 .8581 -.1006 .6774 .5116 .5807 .0980 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6809 .3233 .4723 .4171 19 LEU 19 .8442 -2.1315 999.9900 999.9900 .9565 -.1103 .6704 .1607 .3731 .1000 20 ALA 20 -.1097 999.9900 999.9900 999.9900 .7458 .3180 .6665 .3330 .4720 .4089 21 CYS 21 -1.1459 999.9900 .1296 999.9900 .9108 -.0352 .6798 .3210 .4705 .1790 22 ALA 22 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6702 .3179 .4647 -.3337 23 ARG 23 -.7228 -1.6149 999.9900 .1593 .8581 -.2322 .6796 .5155 .5839 .0049 24 TYR 24 -.1271 -.9671 999.9900 999.9900 .5630 -.1771 .6773 -.1540 .1924 -.0016 25 PHE 25 -.7849 -.1548 999.9900 999.9900 .7573 -.0608 .6724 .0937 .3348 .1168 26 ILE 26 -.2490 -2.4201 999.9900 999.9900 .6034 -.6886 .6596 .0478 .3027 -.2717 27 ASP 27 -.7969 -3.7306 999.9900 999.9900 .8104 -1.2390 .6798 .3763 .5028 -.5322 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6806 .5371 .5969 .2894 29 THR 29 .8703 999.9900 -.8810 999.9900 .4476 .1456 .6532 -.2625 .1190 .1655 30 ASN 30 1.0488 -2.0766 999.9900 999.9900 .7518 -.0920 .6781 .3833 .5061 .1571 31 LEU 31 .2355 -3.3760 999.9900 999.9900 .9565 -.7280 .6763 .1547 .3720 -.2706 32 LYS 32 .1686 -.1469 999.9900 .4411 .7460 .3300 .6776 .1576 .3743 .3550 33 THR 33 .1421 999.9900 -.8810 999.9900 .4476 -.0971 .6613 -.2458 .1322 .0249 34 HIS 34 .9933 -2.4183 999.9900 999.9900 .6686 -.2521 .6798 .3247 .4726 .0496 35 PHE 35 .1779 -.7766 999.9900 999.9900 .7573 .0529 .6781 .1060 .3444 .1885 36 ARG 36 -.9221 -1.0788 999.9900 .1593 .8581 -.1648 .6833 .5144 .5847 .0534 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6776 .5281 .5904 -.5198 38 LYS 38 1.0429 -2.1617 999.9900 .7184 .7460 .2128 .6722 .1546 .3702 .2701 39 ASP 39 1.0149 -3.1847 999.9900 999.9900 .8104 -.4531 .6702 .3779 .4997 -.0622 40 HIS 40 .7721 1.1894 999.9900 999.9900 .6686 .8767 .6703 .3247 .4687 .7250 41 LYS 41 1.0429 .8571 999.9900 -.4035 .7460 .3678 .6770 .1519 .3707 .3811 42 LYS 42 .6751 -1.1257 999.9900 .2495 .7460 .1589 .6850 .1677 .3832 .2353 43 ARG 43 .3315 -2.8571 999.9900 .1593 .8581 -.2698 .6751 .5197 .5844 -.0220 44 LEU 44 .8475 -.6635 999.9900 999.9900 .9565 .3802 .6799 .1615 .3775 .3964 45 LYS 45 .6751 -1.8181 999.9900 -.4035 .7460 -.2408 .6761 .1562 .3729 -.0531 46 GLN 46 .3572 -1.0287 999.9900 1.3059 .5113 .2864 .6786 .5287 .5911 .3922 47 LEU 47 .8786 -2.2115 999.9900 999.9900 .9565 -.1255 .6717 .1532 .3693 .0897 48 SER 48 -1.3191 999.9900 -.7153 999.9900 .6705 -.4546 .6769 .5373 .5955 -.0299 49 VAL 49 -2.6451 999.9900 .4980 999.9900 .7810 -.4554 .6579 .1279 .3487 -.1161 50 GLU 50 -3.2255 -1.6501 999.9900 -1.0323 .6899 -1.3045 .4967 .5243 .5128 -.6995 51 PRO 51 -2.0489 999.9900 999.9900 999.9900 .4496 -.7996 .5412 -.3611 .0149 -.3548 52 TYR 52 -3.6999 -1.1695 999.9900 999.9900 .5630 -1.4355 .6800 -.1700 .1842 -.7593 53 SER 53 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6690 .5283 .5869 -.5215 54 GLN 54 -3.1236 -2.2325 999.9900 1.3059 .5113 -.8847 .6764 .5231 .5870 -.3899 55 GLU 55 -2.2616 -1.9198 999.9900 -1.0323 .6899 -1.1310 .6677 .5202 .5817 -.5560 56 GLU 56 -2.8104 -1.5476 999.9900 .3501 .6899 -.8295 .6809 .5323 .5942 -.3508 57 ALA 57 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6539 .3207 .4595 -.3371 58 GLU 58 -3.2255 -1.9198 999.9900 -1.0323 .6899 -1.3719 .6776 .5328 .5932 -.7129 59 ARG 59 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .6810 .5230 .5889 -.4862 60 ALA 60 -2.8370 999.9900 999.9900 999.9900 .7458 -1.0456 .6659 .3182 .4631 -.2768 61 ALA 61 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6642 .3242 .4659 -.4326 62 GLY 62 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5894 .4690 .5225 -.4099 63 MET 63 -.6108 -2.5481 999.9900 1.7963 .5203 -.2106 .6710 .5112 .5778 .0566 64 GLY 64 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5860 .4738 .5236 -.4096 65 SER 65 -3.7598 999.9900 -.0289 999.9900 .6705 -1.0394 .6790 .5340 .5944 -.3810 66 TYR 66 -.8584 -2.9749 999.9900 999.9900 .5630 -1.0901 .6737 -.1724 .1802 -.5538 67 VAL 67 999.9900 999.9900 -1.0788 999.9900 999.9900 -1.0788 .6415 -.0965 .2198 -.1779 Means: -1.2433 -1.7036 -.4522 .1824 .7264 -.4862 .6489 .2605 .4232 -.1205 2.00 analyzed_16