1 ASP 1 999.9900 -3.1847 999.9900 999.9900 .8104 -1.1871 .4940 .3376 .4087 -.3857 2 PRO 2 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5472 -.3583 .0190 .2646 3 ASN 3 -2.1824 -.9481 999.9900 999.9900 .7518 -.7929 .6785 .3795 .5041 -.2641 4 ALA 4 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6627 .3122 .4582 -.4360 5 GLU 5 -3.2255 -2.1111 999.9900 -1.0323 .6899 -1.4198 .6767 .5201 .5853 -.7471 6 PHE 6 -3.6149 -.0015 999.9900 999.9900 .7573 -.9530 .6782 .0956 .3384 -.4170 7 ASP 7 -.0277 -3.1847 999.9900 999.9900 .8104 -.8006 .4960 .3841 .4307 -.3044 8 PRO 8 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .5453 -.3880 .0009 -.4274 9 ASP 9 -.9728 -1.9171 999.9900 999.9900 .8104 -.6932 .6729 .3873 .5063 -.2038 10 LEU 10 -.3896 -.8597 999.9900 999.9900 .9565 -.0976 .4897 .1691 .3027 .0732 11 PRO 11 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5485 -.3469 .0262 .2564 12 GLY 12 -.8931 999.9900 999.9900 999.9900 .7883 -.0524 .5818 .4716 .5206 .2371 13 GLY 13 -.8931 999.9900 999.9900 999.9900 .7883 -.0524 .5754 .4699 .5168 .2351 14 GLY 14 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5800 .4781 .5234 -.2063 15 LEU 15 -1.5506 -.6635 999.9900 999.9900 .9565 -.4192 .6773 .1595 .3753 -.0842 16 HIS 16 -2.5191 -1.7284 999.9900 999.9900 .6686 -1.1929 .6803 .3335 .4780 -.5130 17 ARG 17 -.5052 -2.8571 999.9900 .1593 .8581 -.4371 .6745 .5231 .5862 -.1411 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6803 .3225 .4716 .4169 19 LEU 19 .8442 -2.1315 999.9900 999.9900 .9565 -.1103 .6771 .1718 .3823 .1036 20 ALA 20 -.1097 999.9900 999.9900 999.9900 .7458 .3180 .6707 .3060 .4579 .4032 21 CYS 21 -1.1459 999.9900 .1296 999.9900 .9108 -.0352 .6821 .3217 .4719 .1797 22 ALA 22 -2.4409 999.9900 999.9900 999.9900 .7458 -.8476 .6648 .3181 .4626 -.1781 23 ARG 23 -.7228 .4564 999.9900 1.0856 .8581 .5526 .6778 .5236 .5878 .5663 24 TYR 24 -.1271 -1.3246 999.9900 999.9900 .5630 -.2962 .6803 -.1777 .1798 -.0772 25 PHE 25 -.0803 -.1548 999.9900 999.9900 .7573 .1741 .6801 .0935 .3379 .2592 26 ILE 26 -.2490 -3.0500 999.9900 999.9900 .6034 -.8985 .6536 .0474 .3000 -.3989 27 ASP 27 -.7969 -2.6388 999.9900 999.9900 .8104 -.8751 .6785 .3860 .5079 -.3122 28 SER 28 -.4057 999.9900 -.7153 999.9900 .6705 -.1502 .6805 .5327 .5943 .1525 29 THR 29 .8449 999.9900 -.8810 999.9900 .4476 .1372 .6601 -.2599 .1234 .1623 30 ASN 30 1.0488 -3.3254 999.9900 999.9900 .7518 -.5083 .6765 .3762 .5013 -.0944 31 LEU 31 .2355 -3.3760 999.9900 999.9900 .9565 -.7280 .6712 .1528 .3688 -.2720 32 LYS 32 .1686 -1.5918 999.9900 .6812 .7460 .1370 .6809 .1519 .3723 .2168 33 THR 33 .1421 999.9900 -.8810 999.9900 .4476 -.0971 .6526 -.2508 .1256 .0221 34 HIS 34 .9933 -2.4183 999.9900 999.9900 .6686 -.2521 .6761 .3202 .4685 .0480 35 PHE 35 .6090 -.7766 999.9900 999.9900 .7573 .1966 .6794 .1035 .3435 .2745 36 ARG 36 -.9221 .5230 999.9900 .9503 .8581 .4719 .6732 .5255 .5871 .5083 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6828 .5376 .5981 -.5168 38 LYS 38 .2805 -2.9005 999.9900 -.4035 .7460 -.5362 .6785 .1566 .3741 -.2637 39 ASP 39 1.1359 -2.1980 999.9900 999.9900 .8104 -.0839 .6753 .3762 .5008 .1600 40 HIS 40 .6603 1.1894 999.9900 999.9900 .6686 .8394 .6770 .3306 .4749 .7052 41 LYS 41 .7090 -.5094 999.9900 .6506 .7460 .4493 .6759 .1515 .3700 .4391 42 LYS 42 .6751 -1.1257 999.9900 -.4035 .7460 -.1023 .6751 .1615 .3755 .0464 43 ARG 43 .0418 -1.8960 999.9900 .1593 .8581 -.1355 .6743 .5197 .5842 .0738 44 LEU 44 .9913 -2.9612 999.9900 999.9900 .9565 -.3378 .6786 .1534 .3722 -.0363 45 LYS 45 1.2214 -2.9005 999.9900 -.4035 .7460 -.3480 .6728 .1406 .3623 -.1324 46 GLN 46 .4537 -1.7668 999.9900 1.3059 .5113 .1260 .6758 .5122 .5803 .2820 47 LEU 47 1.1349 -2.9612 999.9900 999.9900 .9565 -.2899 .6779 .1610 .3764 -.0062 48 SER 48 -2.3021 999.9900 -.0289 999.9900 .6705 -.5535 .6763 .5371 .5951 -.0894 49 VAL 49 -1.1433 999.9900 .3968 999.9900 .7810 .0115 .6520 .1206 .3420 .1614 50 GLU 50 -3.2255 -1.9198 999.9900 -1.0323 .6899 -1.3719 .5056 .5239 .5163 -.7430 51 PRO 51 -1.1662 999.9900 999.9900 999.9900 .4496 -.3583 .5411 -.4001 -.0080 -.1439 52 TYR 52 -3.1208 -.5584 999.9900 999.9900 .5630 -1.0388 .6805 -.1847 .1758 -.5241 53 SER 53 -1.7828 999.9900 -.7153 999.9900 .6705 -.6092 .6752 .5277 .5891 -.1250 54 GLN 54 -3.1236 -2.6982 999.9900 1.3059 .5113 -1.0012 .6741 .5250 .5871 -.4676 55 GLU 55 -2.2616 .5296 999.9900 -1.0323 .6899 -.5186 .6769 .5180 .5842 -.1466 56 GLU 56 -2.8104 -.2810 999.9900 -1.0323 .6899 -.8585 .6735 .5187 .5832 -.3736 57 ALA 57 -2.6726 999.9900 999.9900 999.9900 .7458 -.9634 .6640 .3288 .4684 -.2335 58 GLU 58 -3.2255 -1.1891 999.9900 -1.0323 .6899 -1.1893 .6702 .5157 .5801 -.5952 59 ARG 59 -.3136 -1.8960 999.9900 .1593 .8581 -.2066 .6786 .5158 .5836 .0231 60 ALA 60 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6656 .3191 .4635 -.3345 61 ALA 61 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6712 .3092 .4600 -.4346 62 GLY 62 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5778 .4723 .5192 -.2835 63 MET 63 -.5049 -2.5481 999.9900 .9587 .5203 -.3935 .6806 .5260 .5904 -.0612 64 GLY 64 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5887 .4800 .5283 -.1503 65 SER 65 -2.0349 999.9900 .8786 999.9900 .6705 -.1619 .6785 .5334 .5939 .1452 66 TYR 66 -1.0108 -4.1972 999.9900 999.9900 .5630 -1.5483 .6767 -.1674 .1843 -.8271 67 VAL 67 999.9900 999.9900 -1.0788 999.9900 999.9900 -1.0788 .6405 -.0866 .2250 -.1749 Means: -1.0096 -1.7086 -.3165 .1314 .7264 -.4149 .6495 .2590 .4226 -.0770 2.00 analyzed_14