1 MET 1 999.9900 -.4050 999.9900 .9587 .5203 .3580 .6749 .5064 .5830 .4511 2 ALA 2 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6683 .3232 .4670 -.4318 3 ASP 3 -1.1787 -.6186 999.9900 999.9900 .8104 -.3290 .6799 .3795 .5047 .0145 4 THR 4 -.3275 999.9900 1.6096 999.9900 .4476 .5766 .6540 -.2680 .1162 .4231 5 GLY 5 -.5009 999.9900 999.9900 999.9900 .7883 .1437 .5859 .4845 .5296 .3395 6 GLU 6 -.8477 -1.6501 999.9900 -1.0323 .6899 -.7101 .6821 .5296 .5931 -.2714 7 VAL 7 -.0463 999.9900 -.2457 999.9900 .7810 .1630 .6568 .1155 .3410 .2523 8 GLN 8 -.6834 -2.6982 999.9900 1.3059 .5113 -.3911 .6743 .5226 .5858 -.0612 9 PHE 9 -.9952 -.1460 999.9900 999.9900 .7573 -.1280 .6684 .0985 .3359 .0766 10 MET 10 -.9371 -2.5481 999.9900 .9587 .5203 -.5016 .6789 .5164 .5841 -.1352 11 LYS 11 -.6340 -.4196 999.9900 .1140 .7460 -.0159 .4975 .1528 .2964 .0815 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5440 -.3637 .0145 .2511 13 PHE 13 .0900 -4.3038 999.9900 999.9900 .7573 -1.1522 .6750 .0946 .3364 -.5374 14 ILE 14 .3059 -.6929 999.9900 999.9900 .6034 .0721 .6611 .0364 .2967 .1828 15 SER 15 .1386 999.9900 -.7153 999.9900 .6705 .0313 .6757 .5393 .5961 .2618 16 GLU 16 .8171 -1.4588 999.9900 -1.0323 .6899 -.2460 .6725 .5258 .5869 .0357 17 LYS 17 -.6960 -1.2879 999.9900 -.0770 .7460 -.2784 .6756 .1577 .3735 -.0798 18 SER 18 -.1309 999.9900 -.7153 999.9900 .6705 -.0586 .6784 .5215 .5869 .2048 19 SER 19 .7360 999.9900 1.2119 999.9900 .6705 .8728 .6741 .5276 .5886 .7640 20 LYS 20 -3.5196 -1.8181 999.9900 -.0397 .7460 -.9342 .6724 .1562 .3713 -.5489 21 SER 21 .0280 999.9900 -.7153 999.9900 .6705 -.0056 .6774 .5277 .5901 .2376 22 LEU 22 -.0977 -3.3760 999.9900 999.9900 .9565 -.8391 .6789 .1484 .3694 -.3380 23 GLU 23 -.4325 -.3719 999.9900 -1.0323 .6899 -.2867 .6764 .5257 .5885 .0092 24 ILE 24 .2593 -.0177 999.9900 999.9900 .6034 .2816 .4727 .0350 .2174 .2705 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5322 -.3505 .0173 .1608 26 LEU 26 .6509 -1.6805 999.9900 999.9900 .9565 -.0244 .6805 .1476 .3696 .1510 27 GLY 27 .7440 999.9900 999.9900 999.9900 .7883 .7661 .5720 .4643 .5121 .6421 28 PHE 28 -1.7494 -1.5726 999.9900 999.9900 .7573 -.8549 .6795 .1066 .3453 -.3557 29 ASN 29 .9642 -1.4522 999.9900 999.9900 .7518 .0879 .6776 .3783 .5030 .2640 30 GLU 30 .0468 -.4224 999.9900 -1.0323 .6899 -.1795 .6780 .5206 .5862 .0801 31 TYR 31 -.0710 -2.3638 999.9900 999.9900 .5630 -.6239 .6717 -.1813 .1741 -.2763 32 PHE 32 -2.2209 -3.3183 999.9900 999.9900 .7573 -1.5940 .5056 .1148 .2776 -.8323 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5434 -.3824 .0034 .2463 34 ALA 34 -.7637 999.9900 999.9900 999.9900 .7458 -.0090 .4827 .3245 .3904 .1973 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5466 -.3604 .0175 .2639 36 PHE 36 -1.5081 -.5729 999.9900 999.9900 .7573 -.4412 .4934 .0913 .2588 -.1478 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5537 -.3754 .0118 .2040 38 ILE 38 -.4906 -1.4972 999.9900 999.9900 .6034 -.4615 .6558 .0421 .2978 -.1373 39 THR 39 -.5585 999.9900 -.8810 999.9900 .4476 -.3307 .6545 -.2634 .1190 -.1202 40 VAL 40 -.3637 999.9900 -1.0788 999.9900 .7810 -.2205 .6656 .1225 .3488 .0253 41 ASP 41 -.5526 .4694 999.9900 999.9900 .8104 .2424 .6750 .3778 .5017 .3560 42 LEU 42 -.4930 -.1732 999.9900 999.9900 .9565 .0968 .6758 .1574 .3734 .2247 43 LEU 43 -.3571 -2.4128 999.9900 999.9900 .9565 -.6045 .6807 .1596 .3767 -.1946 44 ASP 44 -1.5212 -2.4630 999.9900 999.9900 .8104 -1.0579 .6747 .3861 .5063 -.4226 45 TYR 45 -1.8643 .4960 999.9900 999.9900 .5630 -.2684 .6823 -.1720 .1839 -.0590 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6722 .5306 .5896 -.5204 47 GLY 47 -2.1575 999.9900 999.9900 999.9900 .7883 -.6846 .5719 .4758 .5185 -.0804 48 ARG 48 -.5733 -1.1946 999.9900 1.3960 .8581 .3764 .6774 .5040 .5763 .4377 49 SER 49 .0374 999.9900 .8786 999.9900 .6705 .5289 .6728 .5187 .5829 .5556 50 TRP 50 -.2197 -.6490 999.9900 999.9900 .9378 .0230 .6763 .1897 .3925 .1870 51 THR 51 .4171 999.9900 -.8810 999.9900 .4476 -.0055 .6601 -.2450 .1321 .0798 52 VAL 52 -.1853 999.9900 -1.0788 999.9900 .7810 -.1610 .6602 .1276 .3495 .0610 53 ARG 53 -.5160 -2.8571 999.9900 1.2208 .8581 -.0147 .6776 .5235 .5877 .1611 54 MET 54 -.7980 -.0261 999.9900 .9587 .5203 .1637 .6769 .5223 .5867 .3090 55 LYS 55 -.2455 -1.5918 999.9900 -.0770 .7460 -.2491 .6753 .1573 .3731 -.0590 56 LYS 56 -.3543 -.9203 999.9900 -.4035 .7460 -.2671 .6781 .1584 .3749 -.0713 57 ARG 57 -1.4318 -1.7413 999.9900 .1593 .8581 -.3993 .6755 .5176 .5834 -.1147 58 GLY 58 -.4748 999.9900 999.9900 999.9900 .7883 .1567 .5710 .4689 .5143 .3383 59 GLU 59 -.9196 -.8493 999.9900 -1.0323 .6899 -.5278 .6767 .5217 .5863 -.1522 60 LYS 60 -.4999 -1.6955 999.9900 -.4035 .7460 -.4513 .6726 .1660 .3771 -.2025 61 VAL 61 -.0582 999.9900 -1.0788 999.9900 .7810 -.1186 .6593 .1225 .3462 .0852 62 PHE 62 -.2058 .6387 999.9900 999.9900 .7573 .3967 .6750 .1161 .3490 .3963 63 LEU 63 -.7094 -2.4128 999.9900 999.9900 .9565 -.7219 .6735 .1597 .3738 -.2665 64 THR 64 -4.2065 999.9900 -.2947 999.9900 .4476 -1.3512 .6536 -.2666 .1168 -.7333 65 VAL 65 -1.2071 999.9900 -1.0788 999.9900 .7810 -.5016 .6525 .1280 .3465 -.1449 66 GLY 66 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5902 .4804 .5292 -.4069 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6771 .2002 .3989 -.4526 68 GLU 68 .6116 -2.8418 999.9900 .3501 .6899 -.2976 .6786 .5218 .5871 .0017 69 ASN 69 1.1272 -2.0766 999.9900 999.9900 .7518 -.0658 .6706 .3776 .4997 .1701 70 PHE 70 1.1962 -.6612 999.9900 999.9900 .7573 .4308 .6737 .1074 .3434 .4147 71 VAL 71 .5646 999.9900 -1.0788 999.9900 .7810 .0890 .6579 .1151 .3413 .2080 72 LYS 72 .6780 -1.1257 999.9900 .6177 .7460 .3068 .6742 .1419 .3637 .3357 73 ASP 73 .2706 -.7152 999.9900 999.9900 .8104 .1219 .6786 .3792 .5040 .2847 74 ASN 74 .2400 -1.7113 999.9900 999.9900 .7518 -.2398 .6745 .3746 .4996 .0659 75 ASN 75 -3.4329 -1.0148 999.9900 999.9900 .7518 -1.2320 .6748 .3825 .5043 -.5277 76 LEU 76 -.7230 -.4539 999.9900 999.9900 .9565 -.0735 .6780 .1619 .3769 .1239 77 GLU 77 -1.1499 -1.0407 999.9900 -1.0323 .6899 -.6332 .6702 .5237 .5847 -.2232 78 ASP 78 -.7312 -1.5978 999.9900 999.9900 .8104 -.5062 .6774 .3924 .5111 -.0898 79 GLY 79 -2.1575 999.9900 999.9900 999.9900 .7883 -.6846 .5792 .4643 .5154 -.0814 80 LYS 80 -.7292 -2.9005 999.9900 .1140 .7460 -.5311 .6745 .1556 .3718 -.2608 81 TYR 81 .6005 -4.1972 999.9900 999.9900 .5630 -1.0113 .6805 -.1713 .1836 -.5049 82 LEU 82 -.4738 -3.3760 999.9900 999.9900 .9565 -.9644 .6739 .1575 .3727 -.4124 83 GLN 83 -.3535 -.7562 999.9900 1.3059 .5113 .1769 .6724 .5226 .5850 .3171 84 PHE 84 -.2457 .0419 999.9900 999.9900 .7573 .1845 .6770 .0994 .3401 .2660 85 ILE 85 .3543 -1.6252 999.9900 999.9900 .6034 -.2225 .6553 .0507 .3026 .0077 86 TYR 86 .2346 -2.9749 999.9900 999.9900 .5630 -.7258 .6718 -.1920 .1679 -.3395 87 ASP 87 -1.7533 -2.3194 999.9900 999.9900 .8104 -1.0874 .6813 .3836 .5076 -.4395 88 ARG 88 -1.4842 -1.8960 999.9900 .1593 .8581 -.4407 .6732 .5131 .5798 -.1453 89 ASP 89 -2.5838 -.9083 999.9900 999.9900 .8104 -.8939 .6753 .3805 .5034 -.3252 90 ARG 90 -1.6758 -2.8571 999.9900 .1593 .8581 -.6712 .6778 .5141 .5823 -.3092 91 THR 91 .3447 999.9900 -.8810 999.9900 .4476 -.0296 .6637 -.2538 .1285 .0642 92 PHE 92 -.0244 -1.4910 999.9900 999.9900 .7573 -.2527 .6789 .1119 .3482 .0066 93 TYR 93 .2641 -1.8096 999.9900 999.9900 .5630 -.3275 .6784 -.1657 .1860 -.0939 94 VAL 94 -.5494 999.9900 .4980 999.9900 .7810 .2432 .6602 .1127 .3408 .3005 95 ILE 95 -.7007 .2167 999.9900 999.9900 .6034 .0398 .6605 .0332 .2946 .1626 96 ILE 96 .0813 -.6744 999.9900 999.9900 .6034 .0035 .6535 .0533 .3034 .1434 97 TYR 97 -.6610 -.5167 999.9900 999.9900 .5630 -.2049 .6770 -.1782 .1781 -.0232 98 GLY 98 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5859 .4758 .5247 -.4091 99 HIS 99 -1.0475 -.3484 999.9900 999.9900 .6686 -.2424 .6787 .3318 .4764 .0566 100 ASN 100 -.6067 -.7217 999.9900 999.9900 .7518 -.1922 .6809 .3903 .5114 .0989 101 MET 101 -1.0204 -.6706 999.9900 .9587 .5203 -.0530 .6773 .5119 .5808 .1629 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6821 .2321 .4249 .3479 Means: -.6213 -1.4273 -.3743 .1662 .7095 -.2731 .6518 .2119 .3960 -.0019 2.00 analyzed_16