1 MET 1 999.9900 -1.7864 999.9900 .9587 .5203 -.1025 .6737 .4985 .5782 .1730 2 THR 2 -.1023 999.9900 .2916 999.9900 .4476 .2123 .6589 -.2662 .1193 .2059 3 GLU 3 -.6559 -1.7714 999.9900 -1.0323 .6899 -.6924 .6774 .5284 .5905 -.2606 4 VAL 4 -.0346 999.9900 -1.0788 999.9900 .7810 -.1108 .6585 .1320 .3514 .0917 5 TYR 5 .5504 -.6802 999.9900 999.9900 .5630 .1444 .6758 -.1711 .1818 .1876 6 ASP 6 -.0745 -.5889 999.9900 999.9900 .8104 .0490 .6747 .3742 .4994 .2392 7 LEU 7 -.7230 -3.3760 999.9900 999.9900 .9565 -1.0475 .6797 .1588 .3759 -.4608 8 GLU 8 -.4615 -.8834 999.9900 -1.0323 .6899 -.4218 .6722 .5184 .5825 -.0828 9 ILE 9 -.6670 -.6139 999.9900 999.9900 .6034 -.2259 .6567 .0478 .3015 .0054 10 THR 10 -.5707 999.9900 -.8810 999.9900 .4476 -.3347 .6585 -.2553 .1254 -.1202 11 THR 11 -.8088 999.9900 -.8810 999.9900 .4476 -.4141 .6549 -.2599 .1212 -.1694 12 ASN 12 -.3337 -1.2512 999.9900 999.9900 .7518 -.2777 .6744 .3690 .4962 .0421 13 ALA 13 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .6644 .3074 .4561 .3898 14 THR 14 .2564 999.9900 -.8810 999.9900 .4476 -.0590 .6574 -.2681 .1175 .0425 15 ASP 15 -.5406 -2.1980 999.9900 999.9900 .8104 -.6427 .6791 .3801 .5047 -.1738 16 PHE 16 -.5261 -.9296 999.9900 999.9900 .7573 -.2328 .4977 .1088 .2709 -.0184 17 PRO 17 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5417 -.3595 .0160 .2516 18 MET 18 -.2142 -2.5481 999.9900 .9587 .5203 -.3208 .6725 .5179 .5823 -.0155 19 GLU 19 -.6163 -.7281 999.9900 -1.0323 .6899 -.4217 .6831 .5162 .5857 -.0812 20 LYS 20 -.5771 -1.9682 999.9900 -.4035 .7460 -.5213 .6750 .1604 .3748 -.2530 21 LYS 21 -.1765 -.6840 999.9900 .8769 .7460 .3279 .6748 .1660 .3780 .3543 22 TYR 22 .0777 -4.1972 999.9900 999.9900 .5630 -1.1855 .4898 -.1780 .1002 -.6490 23 PRO 23 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5414 -.3879 -.0007 .2444 24 ALA 24 -2.2766 999.9900 999.9900 999.9900 .7458 -.7654 .6647 .3237 .4658 -.1356 25 GLY 25 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5882 .4834 .5300 -.4066 26 MET 26 -2.6662 -1.5870 999.9900 .9587 .5203 -.6936 .6770 .5190 .5848 -.2630 27 SER 27 -.3889 999.9900 -.7153 999.9900 .6705 -.1446 .6741 .5411 .5965 .1563 28 LEU 28 .4996 -3.3760 999.9900 999.9900 .9565 -.6400 .6726 .1475 .3663 -.2200 29 ASN 29 .9642 .2511 999.9900 999.9900 .7518 .6557 .6757 .3812 .5039 .6048 30 ASP 30 1.3227 -1.6521 999.9900 999.9900 .8104 .1603 .6800 .3840 .5074 .3090 31 LEU 31 .9913 -2.5464 999.9900 999.9900 .9565 -.1995 .6780 .1576 .3745 .0474 32 LYS 32 1.0429 -.8858 999.9900 -.4035 .7460 .0192 .6773 .1560 .3732 .1328 33 LYS 33 1.0838 -1.3520 999.9900 -.4035 .7460 -.0658 .6774 .1583 .3746 .0724 34 LYS 34 1.2214 -1.5918 999.9900 -.4035 .7460 -.0863 .6800 .1550 .3738 .0577 35 LEU 35 -.0169 -1.3818 999.9900 999.9900 .9565 -.1474 .6772 .1603 .3757 .0791 36 GLU 36 .6833 -.5367 999.9900 -1.0323 .6899 -.0490 .6786 .5334 .5939 .1694 37 LEU 37 1.1349 -1.0230 999.9900 999.9900 .9565 .3561 .6720 .1531 .3693 .3787 38 VAL 38 -.2954 999.9900 .8055 999.9900 .7810 .4304 .6597 .1302 .3508 .4162 39 VAL 39 -1.0844 999.9900 .7395 999.9900 .7810 .1454 .6548 .1282 .3476 .2438 40 GLY 40 -.1327 999.9900 999.9900 999.9900 .7883 .3278 .5865 .4727 .5233 .4287 41 THR 41 -1.4183 999.9900 -.8810 999.9900 .4476 -.6172 .6618 -.2493 .1303 -.2878 42 THR 42 .3531 999.9900 -.8810 999.9900 .4476 -.0268 .6511 -.2449 .1285 .0652 43 VAL 43 -.8680 999.9900 .8662 999.9900 .7810 .2597 .6609 .1373 .3555 .3155 44 ASP 44 .1889 -3.7306 999.9900 999.9900 .8104 -.9104 .6750 .3750 .5000 -.3363 45 SER 45 -1.8383 999.9900 -.7153 999.9900 .6705 -.6277 .6795 .5379 .5969 -.1332 46 MET 46 -.6343 -.9517 999.9900 .9587 .5203 -.0268 .6749 .5243 .5870 .1820 47 ARG 47 -.4636 -1.6149 999.9900 .1593 .8581 -.1804 .6795 .5215 .5873 .0427 48 ILE 48 .3059 -.6139 999.9900 999.9900 .6034 .0984 .6501 .0489 .2994 .1989 49 GLN 49 -.1803 -.4594 999.9900 1.3059 .5113 .2944 .6792 .5289 .5915 .3976 50 LEU 50 -.4786 -1.9980 999.9900 999.9900 .9565 -.5067 .6800 .1589 .3760 -.1362 51 PHE 51 -.5116 -.1815 999.9900 999.9900 .7573 .0214 .6713 .1021 .3393 .1675 52 ASP 52 -1.0188 -2.3194 999.9900 999.9900 .8104 -.8426 .6756 .3774 .5016 -.2950 53 GLY 53 .2047 999.9900 999.9900 999.9900 .7883 .4965 .5819 .4743 .5222 .5123 54 ASP 54 -3.3417 -1.6521 999.9900 999.9900 .8104 -1.3945 .6815 .3919 .5126 -.6220 55 ASP 55 -3.3417 -1.8420 999.9900 999.9900 .8104 -1.4578 .6742 .3796 .5023 -.6639 56 GLN 56 -3.1236 -2.6982 999.9900 1.3059 .5113 -1.0012 .6786 .5213 .5868 -.4675 57 LEU 57 -.1479 -2.9612 999.9900 999.9900 .9565 -.7175 .6802 .1614 .3776 -.2622 58 LYS 58 -.6960 -1.5918 999.9900 .1731 .7460 -.2391 .6685 .1515 .3669 -.0537 59 GLY 59 .0644 999.9900 999.9900 999.9900 .7883 .4263 .5765 .4683 .5164 .4744 60 GLU 60 -.6163 .6653 999.9900 .3501 .6899 .2723 .6798 .5244 .5891 .3822 61 LEU 61 -3.7702 -2.5464 999.9900 999.9900 .9565 -1.7867 .6716 .1555 .3705 -.9066 62 THR 62 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6493 -.2481 .1258 -.8477 63 ASP 63 -3.3417 -2.3194 999.9900 999.9900 .8104 -1.6169 .6783 .3836 .5064 -.7577 64 GLY 64 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5751 .4597 .5110 -.4158 65 ALA 65 -.5171 999.9900 999.9900 999.9900 .7458 .1144 .6634 .3205 .4634 .3031 66 LYS 66 -3.5196 -1.3520 999.9900 -.4035 .7460 -.9865 .6799 .1657 .3799 -.5839 67 SER 67 -.6802 999.9900 -.7153 999.9900 .6705 -.2417 .6732 .5340 .5920 .0964 68 LEU 68 -.1625 -.1732 999.9900 999.9900 .9565 .2069 .6795 .1461 .3683 .2893 69 LYS 69 .6751 -.5697 999.9900 -.4035 .7460 .0089 .6757 .1552 .3721 .1250 70 ASP 70 .6201 -1.6521 999.9900 999.9900 .8104 -.0739 .6758 .3853 .5063 .1679 71 LEU 71 -.2213 -1.0979 999.9900 999.9900 .9565 -.1209 .6769 .1516 .3704 .0931 72 GLY 72 .1294 999.9900 999.9900 999.9900 .7883 .4589 .5825 .4726 .5215 .4932 73 VAL 73 -4.3409 999.9900 -1.0788 999.9900 .7810 -1.5462 .6551 .1192 .3425 -.7729 74 ARG 74 -2.9267 -1.0788 999.9900 .1593 .8581 -.5657 .6794 .5188 .5857 -.2329 75 ASP 75 -.2689 -2.6388 999.9900 999.9900 .8104 -.6991 .6739 .3695 .4963 -.2108 76 GLY 76 1.0314 999.9900 999.9900 999.9900 .7883 .9098 .5894 .4799 .5286 .7222 77 TYR 77 -.2520 -4.1972 999.9900 999.9900 .5630 -1.2954 .6781 -.1545 .1925 -.6725 78 ARG 78 -.1685 -.9348 999.9900 .1593 .8581 .0147 .6777 .5117 .5809 .1804 79 ILE 79 -.1796 -1.4255 999.9900 999.9900 .6034 -.3339 .6586 .0496 .3033 -.0587 80 HIS 80 -.1228 -.1773 999.9900 999.9900 .6686 .1228 .6768 .3224 .4700 .2735 81 ALA 81 -.8003 999.9900 999.9900 999.9900 .7458 -.0272 .6720 .3232 .4685 .2352 82 VAL 82 -1.0844 999.9900 -1.0788 999.9900 .7810 -.4607 .6572 .1067 .3361 -.1236 83 ASP 83 -.2452 .3977 999.9900 999.9900 .8104 .3210 .6788 .3805 .5048 .4044 84 VAL 84 -1.3532 999.9900 -1.0788 999.9900 .7810 -.5503 .6595 .1221 .3460 -.1739 85 THR 85 .1579 999.9900 -.8810 999.9900 .4476 -.0918 .6527 -.2511 .1255 .0252 86 GLY 86 -.0783 999.9900 999.9900 999.9900 .7883 .3550 .5891 .4699 .5229 .4422 87 GLY 87 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5702 .4649 .5117 -.0302 88 ASN 88 -.4415 -.1227 999.9900 999.9900 .7518 .0625 .6770 .3902 .5097 .2510 89 GLU 89 -3.2255 -1.9198 999.9900 .3501 .6899 -1.0263 .6736 .5268 .5879 -.4842 90 ASP 90 999.9900 -1.1348 999.9900 999.9900 999.9900 -1.1348 .6748 .3547 .4919 -.0351 Means: -.6738 -1.4873 -.5514 .0362 .7218 -.3095 .6570 .2333 .4109 -.0168 2.00 analyzed_5