1 ASP 1 999.9900 -3.7306 999.9900 999.9900 .8104 -1.4601 .4863 .3397 .4063 -.5236 2 PRO 2 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .5378 -.3626 .0126 .0821 3 ASN 3 .1528 -2.3357 999.9900 999.9900 .7518 -.4770 .6802 .3911 .5116 -.0720 4 ALA 4 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6690 .3146 .4623 -.3348 5 GLU 5 -1.3476 -1.9198 999.9900 -1.0323 .6899 -.9025 .6773 .5157 .5830 -.4028 6 PHE 6 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .6794 .0888 .3349 -.5164 7 ASP 7 -.4836 -3.7306 999.9900 999.9900 .8104 -1.1346 .4916 .3700 .4207 -.5084 8 PRO 8 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .5324 -.3823 -.0012 .0486 9 ASP 9 .4007 -.3845 999.9900 999.9900 .8104 .2755 .6747 .3699 .4969 .3742 10 LEU 10 -.6961 -3.3760 999.9900 999.9900 .9565 -1.0385 .5060 .1533 .3003 -.4912 11 PRO 11 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5514 -.3719 .0128 .2509 12 GLY 12 -.8286 999.9900 999.9900 999.9900 .7883 -.0201 .5951 .4785 .5303 .2583 13 GLY 13 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .5836 .4741 .5228 .3153 14 GLY 14 -.1741 999.9900 999.9900 999.9900 .7883 .3071 .5776 .4750 .5206 .4167 15 LEU 15 -2.4740 -3.3760 999.9900 999.9900 .9565 -1.6312 .6748 .1450 .3658 -.8147 16 HIS 16 -3.0884 .1724 999.9900 999.9900 .6686 -.7491 .6796 .3299 .4756 -.2476 17 ARG 17 -.4343 -2.8571 999.9900 .6901 .8581 -.2106 .6754 .5107 .5793 .0190 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6810 .3126 .4661 .4150 19 LEU 19 .8442 -3.3760 999.9900 999.9900 .9565 -.5251 .6736 .1409 .3628 -.1522 20 ALA 20 -.1097 999.9900 999.9900 999.9900 .7458 .3180 .6683 .3147 .4620 .4048 21 CYS 21 -.9252 999.9900 .1296 999.9900 .9108 .0384 .6745 .3146 .4646 .2209 22 ALA 22 -2.0449 999.9900 999.9900 999.9900 .7458 -.6496 .6657 .3266 .4679 -.0767 23 ARG 23 -.2684 -.2494 999.9900 .1593 .8581 .1318 .6816 .5149 .5843 .2651 24 TYR 24 -.7788 -2.1671 999.9900 999.9900 .5630 -.7943 .6778 -.1707 .1829 -.3752 25 PHE 25 -.7849 .1608 999.9900 999.9900 .7573 .0444 .6797 .0980 .3404 .1822 26 ILE 26 -1.3252 -.2546 999.9900 999.9900 .6034 -.3255 .6493 .0390 .2933 -.0576 27 ASP 27 -.9954 -1.4116 999.9900 999.9900 .8104 -.5322 .6759 .3780 .5021 -.1085 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6776 .5304 .5917 .2874 29 THR 29 .8449 999.9900 -.8810 999.9900 .4476 .1372 .6599 -.2493 .1295 .1644 30 ASN 30 1.0488 -.7732 999.9900 999.9900 .7518 .3425 .6731 .3718 .4973 .4145 31 LEU 31 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .6742 .1546 .3711 -.1199 32 LYS 32 .7090 -2.1617 999.9900 .6506 .7460 .1189 .6763 .1556 .3726 .2038 33 THR 33 .7717 999.9900 -.8810 999.9900 .4476 .1128 .6536 -.2483 .1275 .1487 34 HIS 34 .9933 -3.1083 999.9900 999.9900 .6686 -.4821 .6820 .3329 .4783 -.0863 35 PHE 35 -1.2463 -.8889 999.9900 999.9900 .7573 -.4593 .6731 .1050 .3417 -.1200 36 ARG 36 .3041 -1.4154 999.9900 .6901 .8581 .2254 .6790 .5129 .5821 .3313 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6779 .5271 .5900 -.5199 38 LYS 38 .1686 -2.9005 999.9900 -.4035 .7460 -.5586 .6754 .1567 .3728 -.2801 39 ASP 39 .9921 -2.1980 999.9900 999.9900 .8104 -.1318 .6684 .3686 .4936 .1283 40 HIS 40 .7721 1.1894 999.9900 999.9900 .6686 .8767 .6761 .3134 .4645 .7239 41 LYS 41 .7090 1.1776 999.9900 -.4035 .7460 .3651 .6788 .1614 .3770 .3808 42 LYS 42 .6751 -1.2293 999.9900 -.0770 .7460 .0076 .6756 .1608 .3753 .1249 43 ARG 43 .0418 -1.8960 999.9900 .1593 .8581 -.1355 .6805 .5248 .5897 .0754 44 LEU 44 .6296 -2.9612 999.9900 999.9900 .9565 -.4584 .6746 .1597 .3743 -.1082 45 LYS 45 1.0838 -2.1617 999.9900 .1140 .7460 -.0208 .6763 .1542 .3717 .1038 46 GLN 46 .4537 -1.9601 999.9900 2.7911 .5113 .4490 .6821 .5151 .5847 .4989 47 LEU 47 -.0169 -2.4128 999.9900 999.9900 .9565 -.4911 .6824 .1484 .3709 -.1285 48 SER 48 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6789 .5367 .5960 -.5178 49 VAL 49 -4.3409 999.9900 .9747 999.9900 .7810 -.8617 .6560 .1220 .3445 -.3614 50 GLU 50 -.9196 -1.5476 999.9900 -1.0323 .6899 -.7024 .4993 .5279 .5160 -.2971 51 PRO 51 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .5520 -.3634 .0180 -.6062 52 TYR 52 -1.7762 -4.1972 999.9900 999.9900 .5630 -1.8035 .6801 -.1703 .1841 -.9801 53 SER 53 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6769 .5354 .5944 -.5185 54 GLN 54 -3.1236 -1.7668 999.9900 1.3059 .5113 -.7683 .6759 .5205 .5852 -.3128 55 GLU 55 -2.5676 -2.1111 999.9900 -1.0323 .6899 -1.2553 .6733 .5149 .5809 -.6388 56 GLU 56 -1.5650 -.8834 999.9900 -1.0323 .6899 -.6977 .6821 .5248 .5904 -.2640 57 ALA 57 -2.6726 999.9900 999.9900 999.9900 .7458 -.9634 .6682 .3085 .4584 -.2375 58 GLU 58 -1.2977 -1.0407 999.9900 -1.0323 .6899 -.6702 .6745 .5128 .5802 -.2489 59 ARG 59 -.4155 -.2657 999.9900 .1593 .8581 .0991 .6774 .5192 .5851 .2417 60 ALA 60 -2.8370 999.9900 999.9900 999.9900 .7458 -1.0456 .6655 .3159 .4616 -.2774 61 ALA 61 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6632 .3187 .4622 -.3352 62 GLY 62 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5753 .4748 .5195 -.4120 63 MET 63 -.7980 -2.5481 999.9900 .9587 .5203 -.4668 .6738 .5216 .5850 -.1119 64 GLY 64 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5850 .4718 .5221 -.0248 65 SER 65 -1.2373 999.9900 -.7153 999.9900 .6705 -.4274 .6806 .5319 .5939 -.0139 66 TYR 66 -.5197 -1.5559 999.9900 999.9900 .5630 -.5042 .6714 -.1907 .1685 -.2064 67 VAL 67 999.9900 999.9900 -1.0788 999.9900 999.9900 -1.0788 .6443 -.1184 .2085 -.1843 Means: -.9174 -1.7639 -.4712 .1204 .7264 -.4067 .6495 .2570 .4214 -.0724 2.00 analyzed_18