1 MET 1 999.9900 .0433 999.9900 .9587 .5203 .5074 .6741 .5102 .5847 .5413 2 ALA 2 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6705 .3246 .4687 -.4309 3 ASP 3 -1.0941 -2.4630 999.9900 999.9900 .8104 -.9156 .6753 .3787 .5023 -.3385 4 THR 4 .0584 999.9900 .4804 999.9900 .4476 .3288 .6594 -.2511 .1283 .2789 5 GLY 5 -.5702 999.9900 999.9900 999.9900 .7883 .1090 .5910 .4794 .5290 .3221 6 GLU 6 -3.2255 -1.4588 999.9900 -1.0323 .6899 -1.2567 .6762 .5260 .5886 -.6374 7 VAL 7 -.0463 999.9900 -.5532 999.9900 .7810 .0605 .6548 .1226 .3443 .1918 8 GLN 8 -.5881 -2.6982 999.9900 1.3059 .5113 -.3673 .6733 .5172 .5822 -.0464 9 PHE 9 -.4296 -.1636 999.9900 999.9900 .7573 .0547 .6763 .0911 .3350 .1863 10 MET 10 -.2922 -.0261 999.9900 .9587 .5203 .2902 .6765 .5126 .5809 .3916 11 LYS 11 -.6340 -.4196 999.9900 -.0397 .7460 -.0774 .4826 .1590 .2938 .0364 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5467 -.3478 .0249 .2558 13 PHE 13 .1032 -.5870 999.9900 999.9900 .7573 .0912 .6752 .1031 .3415 .2104 14 ILE 14 .2768 -1.6252 999.9900 999.9900 .6034 -.2483 .6620 .0378 .2979 -.0090 15 SER 15 .4640 999.9900 .8786 999.9900 .6705 .6711 .6768 .5293 .5907 .6438 16 GLU 16 .1025 -.7281 999.9900 1.1588 .6899 .3058 .6723 .5157 .5810 .4019 17 LYS 17 -1.4779 -.8217 999.9900 -.4035 .7460 -.4721 .6752 .1659 .3781 -.2171 18 SER 18 -.1309 999.9900 -.7153 999.9900 .6705 -.0586 .6781 .5347 .5945 .2074 19 SER 19 .6370 999.9900 -.7153 999.9900 .6705 .1974 .6801 .5316 .5934 .3608 20 LYS 20 -2.2985 -.1814 999.9900 .8261 .7460 -.0163 .6742 .1466 .3665 .1056 21 SER 21 .0184 999.9900 -.7153 999.9900 .6705 -.0088 .6740 .5220 .5853 .2339 22 LEU 22 -.2246 -3.3760 999.9900 999.9900 .9565 -.8813 .6682 .1554 .3691 -.3641 23 GLU 23 -.5863 -.5796 999.9900 -1.0323 .6899 -.3771 .6790 .5285 .5912 -.0501 24 ILE 24 .0813 -.2679 999.9900 999.9900 .6034 .1390 .4600 .0515 .2217 .1857 25 PRO 25 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5381 -.3712 .0077 .2591 26 LEU 26 .8786 -1.2150 999.9900 999.9900 .9565 .2067 .6719 .1515 .3684 .2887 27 GLY 27 -.3460 999.9900 999.9900 999.9900 .7883 .2211 .5905 .4757 .5267 .3771 28 PHE 28 -1.7494 -.8499 999.9900 999.9900 .7573 -.6140 .6760 .1128 .3474 -.2106 29 ASN 29 .9642 -2.3357 999.9900 999.9900 .7518 -.2066 .6743 .3811 .5033 .0871 30 GLU 30 -.2702 -1.7714 999.9900 -1.0323 .6899 -.5960 .6751 .5285 .5896 -.1967 31 TYR 31 .6431 -4.1972 999.9900 999.9900 .5630 -.9971 .6757 -.1594 .1886 -.4950 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4935 .1098 .2697 -.5493 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5434 -.3549 .0194 .2531 34 ALA 34 -.7637 999.9900 999.9900 999.9900 .7458 -.0090 .4689 .3149 .3790 .1915 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5544 -.3567 .0230 .2668 36 PHE 36 -1.5081 -4.3038 999.9900 999.9900 .7573 -1.6849 .4858 .0954 .2581 -.8947 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5344 -.3913 -.0056 .1952 38 ILE 38 -1.3252 -.5232 999.9900 999.9900 .6034 -.4150 .6597 .0366 .2962 -.1097 39 THR 39 -.5585 999.9900 -.8810 999.9900 .4476 -.3307 .6530 -.2436 .1300 -.1165 40 VAL 40 -.0582 999.9900 -.0276 999.9900 .7810 .2317 .6550 .1358 .3521 .2972 41 ASP 41 -.5526 -.5192 999.9900 999.9900 .8104 -.0871 .6746 .3919 .5097 .1610 42 LEU 42 .0291 -.6965 999.9900 999.9900 .9565 .0963 .6722 .1553 .3707 .2233 43 LEU 43 .0291 -3.3760 999.9900 999.9900 .9565 -.7968 .6782 .1481 .3690 -.3128 44 ASP 44 -1.5212 -2.8653 999.9900 999.9900 .8104 -1.1920 .6802 .3796 .5049 -.5033 45 TYR 45 -2.5417 -3.2286 999.9900 999.9900 .5630 -1.7358 .6792 -.1780 .1792 -.9412 46 SER 46 -3.2405 999.9900 -.7153 999.9900 .6705 -1.0951 .6795 .5283 .5913 -.4155 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5843 .4715 .5216 -.1535 48 ARG 48 -.5733 -.7463 999.9900 1.0776 .8581 .3388 .6787 .5282 .5909 .4144 49 SER 49 -.0526 999.9900 1.2119 999.9900 .6705 .6099 .6744 .5318 .5912 .6072 50 TRP 50 -.5632 -.6490 999.9900 999.9900 .9378 -.0915 .6767 .1906 .3932 .1186 51 THR 51 .2184 999.9900 -.8810 999.9900 .4476 -.0717 .6579 -.2635 .1204 .0359 52 VAL 52 -.0582 999.9900 -1.0788 999.9900 .7810 -.1186 .6611 .1190 .3449 .0848 53 ARG 53 -.5160 -2.0954 999.9900 .1593 .8581 -.2869 .6819 .5150 .5846 -.0340 54 MET 54 -.1902 .1642 999.9900 .9587 .5203 .3632 .6739 .5187 .5834 .4409 55 LYS 55 -1.0774 -1.9682 999.9900 -.4035 .7460 -.6213 .6747 .1622 .3758 -.3242 56 LYS 56 -.3286 -2.4344 999.9900 -.4035 .7460 -.5648 .6777 .1581 .3746 -.2840 57 ARG 57 -2.0927 -.9796 999.9900 1.4811 .8581 .1496 .6757 .5206 .5852 .2777 58 GLY 58 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5831 .4713 .5210 -.4109 59 GLU 59 -1.0162 -1.0407 999.9900 .3501 .6899 -.2542 .6747 .5239 .5868 .0303 60 LYS 60 -.3223 -1.3520 999.9900 -.4035 .7460 -.3471 .6788 .1547 .3731 -.1288 61 VAL 61 -.9687 999.9900 -.2457 999.9900 .7810 -.1444 .6520 .1129 .3375 .0663 62 PHE 62 -.4041 .1608 999.9900 999.9900 .7573 .1714 .6731 .1145 .3473 .2603 63 LEU 63 -.7094 -2.1315 999.9900 999.9900 .9565 -.6281 .6787 .1667 .3800 -.2078 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6589 -.2636 .1208 -.8489 65 VAL 65 -1.2071 999.9900 -1.0788 999.9900 .7810 -.5016 .6633 .1280 .3510 -.1427 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5806 .4668 .5173 -.1556 67 TRP 67 .2222 -3.3859 999.9900 999.9900 .9378 -.7419 .6755 .1897 .3921 -.2721 68 GLU 68 1.0761 -.2138 999.9900 .3501 .6899 .4756 .6754 .5276 .5891 .5175 69 ASN 69 1.1117 -.4625 999.9900 999.9900 .7518 .4670 .6750 .3875 .5073 .4927 70 PHE 70 .8041 -1.8165 999.9900 999.9900 .7573 -.0850 .6732 .1023 .3402 .1041 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6497 .1329 .3482 .2937 72 LYS 72 .9480 -.8858 999.9900 -.0770 .7460 .1309 .6731 .1520 .3691 .2113 73 ASP 73 .9921 -1.7105 999.9900 999.9900 .8104 .0307 .6752 .3749 .5000 .2284 74 ASN 74 .2400 -2.7010 999.9900 999.9900 .7518 -.5697 .6810 .3824 .5068 -.1292 75 ASN 75 -3.4329 -.5828 999.9900 999.9900 .7518 -1.0880 .6772 .3833 .5058 -.4407 76 LEU 76 -1.9664 -2.4128 999.9900 999.9900 .9565 -1.1409 .6765 .1474 .3679 -.5198 77 GLU 77 -1.3743 -2.8418 999.9900 .3501 .6899 -.7940 .6760 .5241 .5874 -.3293 78 ASP 78 -1.5212 -2.0001 999.9900 999.9900 .8104 -.9036 .6799 .3875 .5094 -.3287 79 GLY 79 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5812 .4761 .5228 -.4102 80 LYS 80 -.5681 .9683 999.9900 -.4035 .7460 .0678 .6773 .1610 .3761 .1682 81 TYR 81 .0406 -.2699 999.9900 999.9900 .5630 .1112 .6773 -.1799 .1772 .1662 82 LEU 82 -.0977 -.1374 999.9900 999.9900 .9565 .2405 .6789 .1600 .3762 .3121 83 GLN 83 -.1966 -2.6982 999.9900 1.3059 .5113 -.2694 .6709 .5210 .5835 .0191 84 PHE 84 -.2457 .0967 999.9900 999.9900 .7573 .2028 .6781 .1050 .3438 .2783 85 ILE 85 .3543 -.9493 999.9900 999.9900 .6034 .0028 .6541 .0424 .2973 .1410 86 TYR 86 .4225 -.9671 999.9900 999.9900 .5630 .0061 .6726 -.1823 .1739 .1017 87 ASP 87 -.6028 -2.6388 999.9900 999.9900 .8104 -.8104 .6771 .3828 .5054 -.2742 88 ARG 88 -1.2976 -1.8960 999.9900 .1593 .8581 -.4034 .6811 .5201 .5871 -.1165 89 ASP 89 -2.8635 -1.7105 999.9900 999.9900 .8104 -1.2545 .6784 .3915 .5110 -.5387 90 ARG 90 -1.1245 -1.1946 999.9900 .9503 .8581 .0879 .6736 .5214 .5848 .2335 91 THR 91 .2328 999.9900 -.8810 999.9900 .4476 -.0669 .6526 -.2604 .1200 .0383 92 PHE 92 .1097 -2.0028 999.9900 999.9900 .7573 -.3786 .6763 .0961 .3378 -.0727 93 TYR 93 .2641 .5582 999.9900 999.9900 .5630 .4618 .6817 -.1864 .1753 .3761 94 VAL 94 .0815 999.9900 .3968 999.9900 .7810 .4198 .6627 .1348 .3547 .4113 95 ILE 95 -.2736 -3.0500 999.9900 999.9900 .6034 -.9067 .6554 .0372 .2948 -.4055 96 ILE 96 .3408 -1.5368 999.9900 999.9900 .6034 -.1975 .6553 .0359 .2940 .0197 97 TYR 97 -.3077 .2775 999.9900 999.9900 .5630 .1776 .6817 -.1686 .1857 .2092 98 GLY 98 -.1408 999.9900 999.9900 999.9900 .7883 .3237 .5844 .4823 .5277 .4286 99 HIS 99 -3.0884 -1.5062 999.9900 999.9900 .6686 -1.3087 .6776 .3250 .4719 -.5847 100 ASN 100 -3.4329 -.7732 999.9900 999.9900 .7518 -1.1514 .6808 .3923 .5125 -.4762 101 MET 101 -1.0204 -.6706 999.9900 .9587 .5203 -.0530 .6733 .5072 .5764 .1614 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6746 .2446 .4289 .3496 Means: -.6834 -1.3611 -.3869 .2717 .7095 -.2663 .6513 .2131 .3965 .0025 2.00 analyzed_5