1 MET 1 999.9900 -1.3058 999.9900 .9587 .5203 .0577 .6770 .5073 .5844 .2715 2 THR 2 -1.0713 999.9900 -.8810 999.9900 .4476 -.5016 .6561 -.2506 .1272 -.2198 3 GLU 3 -3.2255 -1.7714 999.9900 .3501 .6899 -.9892 .6739 .5259 .5876 -.4595 4 VAL 4 -.7132 999.9900 -1.0788 999.9900 .7810 -.3370 .6598 .1266 .3488 -.0449 5 TYR 5 .5504 -.5033 999.9900 999.9900 .5630 .2034 .6747 -.1736 .1799 .2222 6 ASP 6 -.0745 -.8657 999.9900 999.9900 .8104 -.0432 .6771 .3705 .4982 .1836 7 LEU 7 -.5127 -1.0979 999.9900 999.9900 .9565 -.2181 .6819 .1621 .3787 .0380 8 GLU 8 -.4615 -1.1358 999.9900 -1.0323 .6899 -.4849 .6739 .5207 .5846 -.1242 9 ILE 9 -.1408 -1.4255 999.9900 999.9900 .6034 -.3210 .6564 .0373 .2953 -.0538 10 THR 10 -.5707 999.9900 -.8810 999.9900 .4476 -.3347 .6574 -.2616 .1213 -.1217 11 THR 11 -.8088 999.9900 -.8810 999.9900 .4476 -.4141 .6588 -.2458 .1311 -.1658 12 ASN 12 -.6931 -.7217 999.9900 999.9900 .7518 -.2210 .6793 .3780 .5035 .0789 13 ALA 13 -.2135 999.9900 999.9900 999.9900 .7458 .2661 .6713 .3265 .4701 .3825 14 THR 14 .2564 999.9900 .6346 999.9900 .4476 .4462 .6572 -.2674 .1178 .3457 15 ASP 15 -1.2415 -.8452 999.9900 999.9900 .8104 -.4254 .6750 .3797 .5027 -.0443 16 PHE 16 -.8057 -2.6964 999.9900 999.9900 .7573 -.9149 .4818 .0963 .2569 -.4333 17 PRO 17 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5565 -.3475 .0292 .2583 18 MET 18 -.1025 -1.3058 999.9900 .9587 .5203 .0177 .6707 .5155 .5802 .2095 19 GLU 19 -.5863 -.1412 999.9900 -1.0323 .6899 -.2675 .6844 .5333 .5963 .0246 20 LYS 20 -.5771 -1.8181 999.9900 .9312 .7460 .0426 .6770 .1524 .3710 .1489 21 LYS 21 -.2512 -.4905 999.9900 -.4035 .7460 -.1605 .6761 .1512 .3699 .0035 22 TYR 22 .0777 .4830 999.9900 999.9900 .5630 .3746 .4988 -.1745 .1060 .2896 23 PRO 23 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5340 -.3977 -.0095 .2401 24 ALA 24 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6697 .3161 .4634 -.3343 25 GLY 25 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5808 .4706 .5196 -.4117 26 MET 26 -2.2339 -2.0676 999.9900 .9587 .5203 -.7056 .6763 .5136 .5814 -.2721 27 SER 27 -.3889 999.9900 -.7153 999.9900 .6705 -.1446 .6712 .5276 .5875 .1530 28 LEU 28 .4996 -3.3760 999.9900 999.9900 .9565 -.6400 .6767 .1563 .3731 -.2174 29 ASN 29 .9642 -1.4522 999.9900 999.9900 .7518 .0879 .6769 .3812 .5044 .2644 30 ASP 30 1.0815 -1.4992 999.9900 999.9900 .8104 .1309 .6809 .3946 .5139 .2936 31 LEU 31 .8182 -3.3760 999.9900 999.9900 .9565 -.5337 .6790 .1637 .3784 -.1517 32 LYS 32 1.0429 -.8530 999.9900 .6177 .7460 .4343 .6726 .1516 .3687 .4279 33 LYS 33 .6751 -1.9682 999.9900 -.4035 .7460 -.2708 .6762 .1513 .3700 -.0752 34 LYS 34 1.2214 -1.9682 999.9900 -.4035 .7460 -.1616 .6757 .1513 .3698 .0027 35 LEU 35 .0401 -1.2483 999.9900 999.9900 .9565 -.0839 .6766 .1655 .3784 .1181 36 GLU 36 .6116 -.6497 999.9900 .3501 .6899 .2505 .6747 .5237 .5866 .3667 37 LEU 37 .8475 -1.0230 999.9900 999.9900 .9565 .2603 .6771 .1552 .3727 .3227 38 VAL 38 -1.0844 999.9900 .7395 999.9900 .7810 .1454 .6605 .1319 .3521 .2457 39 VAL 39 -1.5335 999.9900 .4980 999.9900 .7810 -.0848 .6555 .1342 .3514 .1071 40 GLY 40 -.1327 999.9900 999.9900 999.9900 .7883 .3278 .5884 .4737 .5247 .4294 41 THR 41 -1.0935 999.9900 .8779 999.9900 .4476 .0773 .6589 -.2454 .1314 .1291 42 THR 42 -.1839 999.9900 -.8810 999.9900 .4476 -.2058 .6584 -.2743 .1143 -.0466 43 VAL 43 -1.4030 999.9900 -1.0788 999.9900 .7810 -.5669 .6548 .1146 .3397 -.1863 44 ASP 44 1.3227 -2.6388 999.9900 999.9900 .8104 -.1685 .6761 .3713 .4983 .1084 45 SER 45 -.3100 999.9900 -.7153 999.9900 .6705 -.1183 .6796 .5245 .5891 .1699 46 MET 46 -.2651 -1.1990 999.9900 .9587 .5203 .0037 .6765 .5137 .5815 .2008 47 ARG 47 -.7228 -.9796 999.9900 .1593 .8581 -.1051 .6769 .5250 .5883 .0966 48 ILE 48 -.1408 -1.4972 999.9900 999.9900 .6034 -.3449 .6582 .0444 .3002 -.0664 49 GLN 49 -.4424 -2.6982 999.9900 2.7911 .5113 .0404 .6822 .5307 .5939 .2291 50 LEU 50 -.4786 -2.3037 999.9900 999.9900 .9565 -.6086 .6767 .1575 .3739 -.1983 51 PHE 51 -.0803 -3.6820 999.9900 999.9900 .7573 -1.0017 .6773 .0847 .3316 -.4486 52 ASP 52 -3.3417 -1.1646 999.9900 999.9900 .8104 -1.2320 .6738 .3766 .5005 -.5291 53 GLY 53 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5846 .4718 .5220 -.4104 54 ASP 54 -2.8635 -2.8653 999.9900 999.9900 .8104 -1.6395 .6841 .3819 .5078 -.7705 55 ASP 55 -3.3417 -3.7306 999.9900 999.9900 .8104 -2.0873 .6732 .3743 .4988 -1.0429 56 GLN 56 -3.1236 -1.9601 999.9900 1.3059 .5113 -.8166 .6780 .5208 .5863 -.3446 57 LEU 57 -.1479 .2515 999.9900 999.9900 .9565 .3534 .6841 .1484 .3716 .3785 58 LYS 58 -1.4779 -2.9005 999.9900 -.4035 .7460 -.8879 .6728 .1673 .3779 -.5142 59 GLY 59 -.4622 999.9900 999.9900 999.9900 .7883 .1631 .5680 .4596 .5078 .3384 60 GLU 60 -.5239 -.1765 999.9900 -1.0323 .6899 -.2607 .6843 .5224 .5899 .0273 61 LEU 61 -3.7702 .2036 999.9900 999.9900 .9565 -.8700 .6696 .1703 .3783 -.3540 62 THR 62 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6531 -.2543 .1238 -.8482 63 ASP 63 -1.1493 -2.3194 999.9900 999.9900 .8104 -.8861 .6761 .3895 .5089 -.3185 64 GLY 64 -.9395 999.9900 999.9900 999.9900 .7883 -.0756 .5933 .4763 .5283 .2296 65 ALA 65 -.5171 999.9900 999.9900 999.9900 .7458 .1144 .6675 .3154 .4621 .3029 66 LYS 66 -2.1934 -1.3520 999.9900 .4996 .7460 -.3600 .6753 .1626 .3762 -.1375 67 SER 67 -.4961 999.9900 -.7153 999.9900 .6705 -.1803 .6697 .5341 .5906 .1326 68 LEU 68 .4996 -2.3037 999.9900 999.9900 .9565 -.2825 .6805 .1453 .3683 -.0044 69 LYS 69 .6751 -.9566 999.9900 .6133 .7460 .3382 .6737 .1589 .3734 .3605 70 ASP 70 1.1285 -.8657 999.9900 999.9900 .8104 .3578 .6802 .3906 .5113 .4288 71 LEU 71 -.5757 -.8871 999.9900 999.9900 .9565 -.1688 .6788 .1540 .3726 .0653 72 GLY 72 .6407 999.9900 999.9900 999.9900 .7883 .7145 .5888 .4693 .5224 .6218 73 VAL 73 -4.3409 999.9900 -1.0788 999.9900 .7810 -1.5462 .6565 .1311 .3500 -.7702 74 ARG 74 -2.9267 1.0644 999.9900 1.2208 .8581 .2875 .6793 .5210 .5870 .3768 75 ASP 75 -.1445 -2.4630 999.9900 999.9900 .8104 -.5990 .6779 .3878 .5087 -.1463 76 GLY 76 .6767 999.9900 999.9900 999.9900 .7883 .7325 .5846 .4744 .5234 .6310 77 TYR 77 -.0710 -2.3638 999.9900 999.9900 .5630 -.6239 .6801 -.1797 .1786 -.2743 78 ARG 78 -.5614 -.0419 999.9900 .1593 .8581 .1147 .6754 .5267 .5887 .2537 79 ILE 79 .3408 -1.4602 999.9900 999.9900 .6034 -.1720 .6615 .0458 .3023 .0382 80 HIS 80 -.1228 .6357 999.9900 999.9900 .6686 .3938 .6784 .3236 .4714 .4367 81 ALA 81 -.8003 999.9900 999.9900 999.9900 .7458 -.0272 .6684 .3097 .4592 .2309 82 VAL 82 -1.0844 999.9900 -1.0788 999.9900 .7810 -.4607 .6562 .1247 .3461 -.1202 83 ASP 83 -.0277 -3.1847 999.9900 999.9900 .8104 -.8006 .6818 .3786 .5049 -.2683 84 VAL 84 .7260 999.9900 .4980 999.9900 .7810 .6684 .6633 .1180 .3452 .5573 85 THR 85 .3736 999.9900 -.8810 999.9900 .4476 -.0200 .6559 -.2598 .1217 .0673 86 GLY 86 -.3460 999.9900 999.9900 999.9900 .7883 .2211 .5736 .4709 .5165 .3717 87 GLY 87 -1.7079 999.9900 999.9900 999.9900 .7883 -.4598 .5953 .4840 .5335 .0399 88 ASN 88 -.1210 -2.0766 999.9900 999.9900 .7518 -.4819 .6784 .3835 .5064 -.0768 89 GLU 89 -3.2255 -2.8418 999.9900 -1.0323 .6899 -1.6024 .6731 .5210 .5844 -.8693 90 ASP 90 999.9900 -3.1847 999.9900 999.9900 999.9900 -3.1847 .6758 .3476 .4882 -.7204 Means: -.6975 -1.5275 -.4722 .2846 .7218 -.2903 .6578 .2324 .4107 -.0050 2.00 analyzed_15