1 ASP 1 999.9900 -2.6388 999.9900 999.9900 .8104 -.9142 .4898 .3475 .4122 -.2478 2 PRO 2 -1.1662 999.9900 999.9900 999.9900 .4496 -.3583 .5474 -.3870 .0023 -.1390 3 ASN 3 -2.0408 -2.0766 999.9900 999.9900 .7518 -1.1218 .6793 .3872 .5089 -.4598 4 ALA 4 -2.0449 999.9900 999.9900 999.9900 .7458 -.6496 .6594 .3109 .4561 -.0822 5 GLU 5 -1.2088 -1.5476 999.9900 -1.0323 .6899 -.7747 .6747 .5307 .5907 -.3156 6 PHE 6 -3.6149 -.3506 999.9900 999.9900 .7573 -1.0694 .6764 .0934 .3363 -.4877 7 ASP 7 -.1930 -2.1980 999.9900 999.9900 .8104 -.5269 .4802 .3763 .4196 -.1448 8 PRO 8 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .5364 -.3766 .0038 -.1261 9 ASP 9 -.8696 -1.4992 999.9900 999.9900 .8104 -.5195 .6804 .3861 .5087 -.0984 10 LEU 10 -.6213 -2.4128 999.9900 999.9900 .9565 -.6925 .4864 .1453 .2874 -.2892 11 PRO 11 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5487 -.3942 -.0013 .1980 12 GLY 12 -1.3026 999.9900 999.9900 999.9900 .7883 -.2571 .5871 .4816 .5285 .1386 13 GLY 13 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .5880 .4868 .5318 .3195 14 GLY 14 1.0314 999.9900 999.9900 999.9900 .7883 .9098 .5741 .4663 .5142 .7150 15 LEU 15 -3.7702 .6031 999.9900 999.9900 .9565 -.7369 .6834 .1562 .3759 -.2742 16 HIS 16 -3.0884 -1.7284 999.9900 999.9900 .6686 -1.3827 .6765 .3243 .4711 -.6295 17 ARG 17 -.1504 -1.8960 999.9900 .1593 .8581 -.1739 .6764 .5169 .5834 .0462 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6756 .3100 .4623 .4134 19 LEU 19 .8442 -2.5464 999.9900 999.9900 .9565 -.2485 .6738 .1576 .3727 .0171 20 ALA 20 .0579 999.9900 999.9900 999.9900 .7458 .4018 .6623 .3236 .4647 .4474 21 CYS 21 -.8048 999.9900 .1296 999.9900 .9108 .0785 .6759 .3151 .4654 .2453 22 ALA 22 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6620 .3251 .4655 -.3339 23 ARG 23 -.6502 -1.2607 999.9900 1.0005 .8581 .1896 .6797 .5183 .5856 .3066 24 TYR 24 -.7788 -1.6992 999.9900 999.9900 .5630 -.6384 .6847 -.1838 .1780 -.2829 25 PHE 25 -.7849 -.1548 999.9900 999.9900 .7573 -.0608 .6768 .0991 .3398 .1187 26 ILE 26 -1.4718 -2.2551 999.9900 999.9900 .6034 -1.0412 .6505 .0318 .2896 -.4882 27 ASP 27 -.5648 -3.7306 999.9900 999.9900 .8104 -1.1617 .6789 .3795 .5043 -.4853 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6738 .5267 .5880 .2859 29 THR 29 .8703 999.9900 -.8810 999.9900 .4476 .1456 .6642 -.2568 .1269 .1688 30 ASN 30 .6990 -2.0766 999.9900 999.9900 .7518 -.2086 .6804 .3789 .5046 .0867 31 LEU 31 .2355 -3.3760 999.9900 999.9900 .9565 -.7280 .6770 .1637 .3776 -.2687 32 LYS 32 .7090 -.6131 999.9900 .1731 .7460 .2376 .6755 .1438 .3653 .2868 33 THR 33 .7717 999.9900 -.8810 999.9900 .4476 .1128 .6544 -.2618 .1200 .1462 34 HIS 34 .9933 -2.4183 999.9900 999.9900 .6686 -.2521 .6720 .3246 .4694 .0480 35 PHE 35 -.5871 -.7766 999.9900 999.9900 .7573 -.2021 .6717 .0938 .3346 .0318 36 ARG 36 .3041 -1.0274 999.9900 .7862 .8581 .3414 .6787 .5109 .5808 .4138 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6736 .5359 .5933 -.5190 38 LYS 38 .7090 -2.9005 999.9900 .4996 .7460 -.0893 .6801 .1522 .3722 .0551 39 ASP 39 1.3227 -2.8653 999.9900 999.9900 .8104 -.2441 .6823 .3775 .5045 .0655 40 HIS 40 .6603 1.1894 999.9900 999.9900 .6686 .8394 .6771 .3128 .4645 .7016 41 LYS 41 .7090 -.5094 999.9900 .7677 .7460 .4962 .6778 .1577 .3744 .4738 42 LYS 42 .8536 -1.0359 999.9900 -.4035 .7460 -.0487 .6714 .1525 .3687 .0829 43 ARG 43 .3315 -2.8571 999.9900 .1593 .8581 -.2698 .6809 .5183 .5861 -.0214 44 LEU 44 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .6748 .1454 .3660 -.1216 45 LYS 45 .6780 -.7093 999.9900 -.4035 .7460 -.0185 .6795 .1551 .3736 .1060 46 GLN 46 -.0365 -2.2325 999.9900 1.3059 .5113 -.1130 .6766 .5226 .5867 .1246 47 LEU 47 .8786 -3.3760 999.9900 999.9900 .9565 -.5136 .6773 .1555 .3730 -.1416 48 SER 48 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6765 .5272 .5894 -.5202 49 VAL 49 -1.8882 999.9900 .5873 999.9900 .7810 -.1733 .6598 .1101 .3392 .0500 50 GLU 50 -3.2255 -.6748 999.9900 -1.0323 .6899 -1.0607 .4913 .5173 .5065 -.5390 51 PRO 51 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5270 -.3796 -.0019 .2542 52 TYR 52 -3.6999 -3.5861 999.9900 999.9900 .5630 -2.2410 .6779 -.2016 .1648 -1.2493 53 SER 53 -2.9368 999.9900 -.7153 999.9900 .6705 -.9939 .6749 .5218 .5856 -.3570 54 GLN 54 -3.1236 -2.6982 999.9900 1.3059 .5113 -1.0012 .6795 .5252 .5895 -.4667 55 GLU 55 -3.2255 -1.9198 999.9900 -1.0323 .6899 -1.3719 .6750 .5194 .5842 -.7156 56 GLU 56 -2.3953 -1.5476 999.9900 -1.0323 .6899 -1.0713 .6783 .5269 .5899 -.5134 57 ALA 57 -2.3529 999.9900 999.9900 999.9900 .7458 -.8035 .6684 .3149 .4622 -.1559 58 GLU 58 -3.2255 .3642 999.9900 -1.0323 .6899 -.8009 .6749 .5244 .5871 -.3341 59 ARG 59 -2.5097 -.2334 999.9900 .1593 .8581 -.3133 .6779 .5183 .5848 -.0529 60 ALA 60 -2.6726 999.9900 999.9900 999.9900 .7458 -.9634 .6630 .3132 .4589 -.2377 61 ALA 61 -2.6726 999.9900 999.9900 999.9900 .7458 -.9634 .6654 .3131 .4599 -.2371 62 GLY 62 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5854 .4791 .5263 -.4084 63 MET 63 -2.6662 -1.1064 999.9900 .9587 .5203 -.5734 .6733 .5199 .5838 -.1834 64 GLY 64 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5767 .4685 .5166 -.4132 65 SER 65 -1.7828 999.9900 -.7153 999.9900 .6705 -.6092 .6800 .5267 .5906 -.1242 66 TYR 66 -3.1208 -2.3638 999.9900 999.9900 .5630 -1.6406 .6781 -.1664 .1855 -.8820 67 VAL 67 999.9900 999.9900 .9747 999.9900 999.9900 .9747 .6524 -.1010 .2219 .5087 Means: -1.1067 -1.7102 -.3198 .1502 .7264 -.4428 .6487 .2558 .4204 -.0948 2.00 analyzed_20