1 ASP 1 999.9900 -3.7306 999.9900 999.9900 .8104 -1.4601 .4988 .3448 .4148 -.5191 2 PRO 2 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .5487 -.3897 .0013 .0780 3 ASN 3 .1528 -1.5725 999.9900 999.9900 .7518 -.2226 .6776 .3793 .5036 .0778 4 ALA 4 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6651 .3250 .4667 -.3332 5 GLU 5 -1.3476 -2.3808 999.9900 -1.0323 .6899 -1.0177 .6785 .5206 .5864 -.4786 6 PHE 6 -3.6149 .1164 999.9900 999.9900 .7573 -.9137 .6730 .0879 .3317 -.3960 7 ASP 7 -1.0188 -2.3194 999.9900 999.9900 .8104 -.8426 .4901 .3770 .4241 -.3321 8 PRO 8 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .5424 -.3701 .0101 -.4236 9 ASP 9 -.8696 -2.6388 999.9900 999.9900 .8104 -.8993 .6811 .3866 .5093 -.3261 10 LEU 10 -.8268 -.9158 999.9900 999.9900 .9565 -.2621 .4889 .1541 .2936 -.0286 11 PRO 11 -5.1268 999.9900 999.9900 999.9900 .4496 -2.3386 .5640 -.3600 .0250 -1.1183 12 GLY 12 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5807 .4641 .5159 -.4133 13 GLY 13 -.1327 999.9900 999.9900 999.9900 .7883 .3278 .5658 .4749 .5153 .4241 14 GLY 14 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5815 .4704 .5198 -.2078 15 LEU 15 -2.1150 -.6635 999.9900 999.9900 .9565 -.6073 .6791 .1573 .3747 -.1971 16 HIS 16 -1.0475 -3.1083 999.9900 999.9900 .6686 -1.1624 .6780 .3259 .4726 -.4967 17 ARG 17 -.9010 -2.8571 999.9900 .1593 .8581 -.5163 .6721 .5154 .5807 -.1991 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6755 .3192 .4676 .4152 19 LEU 19 .8442 -2.5464 999.9900 999.9900 .9565 -.2485 .6737 .1555 .3714 .0167 20 ALA 20 .0579 999.9900 999.9900 999.9900 .7458 .4018 .6619 .3188 .4618 .4461 21 CYS 21 -.8048 999.9900 .1296 999.9900 .9108 .0785 .6783 .3179 .4681 .2464 22 ALA 22 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6650 .3197 .4636 -.3345 23 ARG 23 -.6502 -2.3766 999.9900 .6901 .8581 -.1577 .6806 .5161 .5846 .0583 24 TYR 24 -.7788 -.6967 999.9900 999.9900 .5630 -.3042 .6782 -.1803 .1774 -.0829 25 PHE 25 -.7849 -.1548 999.9900 999.9900 .7573 -.0608 .6801 .0979 .3405 .1191 26 ILE 26 -.2490 -2.2551 999.9900 999.9900 .6034 -.6336 .6580 .0438 .2997 -.2398 27 ASP 27 -.5288 -2.0928 999.9900 999.9900 .8104 -.6038 .6760 .3873 .5076 -.1496 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6798 .5348 .5952 .2887 29 THR 29 .8703 999.9900 -.8810 999.9900 .4476 .1456 .6623 -.2699 .1185 .1658 30 ASN 30 .6990 -3.3254 999.9900 999.9900 .7518 -.6249 .6757 .3813 .5040 -.1635 31 LEU 31 .2355 -3.3760 999.9900 999.9900 .9565 -.7280 .6750 .1473 .3672 -.2723 32 LYS 32 .7090 -1.0793 999.9900 -.4035 .7460 -.0863 .6841 .1579 .3772 .0587 33 THR 33 .7717 999.9900 -.8810 999.9900 .4476 .1128 .6553 -.2466 .1292 .1494 34 HIS 34 .9933 -2.4183 999.9900 999.9900 .6686 -.2521 .6800 .3272 .4742 .0502 35 PHE 35 -1.2463 -.8889 999.9900 999.9900 .7573 -.4593 .6812 .1071 .3463 -.1179 36 ARG 36 -.7545 -1.5080 999.9900 .1593 .8581 -.2171 .6771 .5232 .5873 .0164 37 SER 37 -3.7598 999.9900 .3727 999.9900 .6705 -.9055 .6720 .5243 .5858 -.3041 38 LYS 38 .1686 -2.9005 999.9900 .6177 .7460 -.1501 .6764 .1527 .3709 .0112 39 ASP 39 .6354 -1.9171 999.9900 999.9900 .8104 -.1571 .6724 .3753 .4991 .1153 40 HIS 40 .7721 .9837 999.9900 999.9900 .6686 .8081 .6773 .3275 .4732 .6858 41 LYS 41 .7090 1.1776 999.9900 -.0770 .7460 .4957 .6737 .1584 .3731 .4730 42 LYS 42 .6751 -1.1257 999.9900 -.4035 .7460 -.1023 .6779 .1522 .3712 .0455 43 ARG 43 .0418 -1.7413 999.9900 .6901 .8581 .1077 .6756 .5206 .5852 .2478 44 LEU 44 .6296 -3.3760 999.9900 999.9900 .9565 -.5966 .6707 .1565 .3707 -.1926 45 LYS 45 .7090 .6458 999.9900 -.4035 .7460 .2587 .6803 .1562 .3746 .3043 46 GLN 46 .1030 -2.6982 999.9900 1.3059 .5113 -.1945 .6779 .5181 .5847 .0697 47 LEU 47 .8786 -2.9612 999.9900 999.9900 .9565 -.3754 .6793 .1515 .3714 -.0591 48 SER 48 -.7578 999.9900 -.0289 999.9900 .6705 -.0387 .6806 .5357 .5960 .2200 49 VAL 49 -2.0289 999.9900 .3968 999.9900 .7810 -.2837 .6601 .1208 .3455 -.0140 50 GLU 50 -3.2255 -2.8418 999.9900 .3501 .6899 -1.2568 .4898 .5209 .5079 -.6694 51 PRO 51 -1.9661 999.9900 999.9900 999.9900 .4496 -.7582 .5394 -.3723 .0076 -.3373 52 TYR 52 .2346 -4.1972 999.9900 999.9900 .5630 -1.1332 .6742 -.1796 .1761 -.5810 53 SER 53 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6786 .5393 .5974 -.5173 54 GLN 54 -2.2003 -2.6982 999.9900 1.3059 .5113 -.7703 .6774 .5205 .5859 -.3139 55 GLU 55 -2.8104 -1.5476 999.9900 -1.0323 .6899 -1.1751 .6729 .5192 .5832 -.5847 56 GLU 56 -3.2255 -1.7714 999.9900 -1.0323 .6899 -1.3348 .6800 .5251 .5896 -.6890 57 ALA 57 -1.7252 999.9900 999.9900 999.9900 .7458 -.4897 .6681 .3092 .4588 -.0005 58 GLU 58 -2.8104 .4819 999.9900 -1.0323 .6899 -.6677 .6771 .5108 .5801 -.2472 59 ARG 59 -2.5097 -2.8571 999.9900 .6901 .8581 -.6257 .6754 .5171 .5831 -.2766 60 ALA 60 -1.6732 999.9900 999.9900 999.9900 .7458 -.4637 .6664 .3073 .4569 .0116 61 ALA 61 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6731 .3268 .4711 -.3307 62 GLY 62 -2.1575 999.9900 999.9900 999.9900 .7883 -.6846 .5836 .4643 .5173 -.0803 63 MET 63 -2.6662 -2.5481 999.9900 .9587 .5203 -.9338 .6793 .5189 .5857 -.4229 64 GLY 64 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5943 .4753 .5282 -.4071 65 SER 65 -.4678 999.9900 -.0289 999.9900 .6705 .0579 .6765 .5292 .5906 .2759 66 TYR 66 -3.6999 -1.1415 999.9900 999.9900 .5630 -1.4262 .6812 -.1732 .1828 -.7541 67 VAL 67 999.9900 999.9900 -1.0788 999.9900 999.9900 -1.0788 .6375 -.0803 .2273 -.1738 Means: -1.1462 -1.8493 -.3000 .1153 .7264 -.4856 .6498 .2579 .4221 -.1204 2.00 analyzed_15