1 MET 1 999.9900 -2.5481 999.9900 .9587 .5203 -.3564 .6675 .4939 .5728 .0184 2 ALA 2 -.5138 999.9900 999.9900 999.9900 .7458 .1160 .6710 .3103 .4606 .3033 3 ASP 3 -.1859 -1.4542 999.9900 999.9900 .8104 -.2765 .6754 .3839 .5053 .0459 4 THR 4 -.3275 999.9900 -.8810 999.9900 .4476 -.2537 .6542 -.2605 .1206 -.0735 5 GLY 5 -1.4779 999.9900 999.9900 999.9900 .7883 -.3448 .5791 .4769 .5223 .0916 6 GLU 6 -2.0601 -1.4588 999.9900 .3501 .6899 -.6197 .6745 .5227 .5859 -.2136 7 VAL 7 -.0523 999.9900 -.5532 999.9900 .7810 .0585 .6566 .1157 .3410 .1896 8 GLN 8 -.3854 .1268 999.9900 1.3059 .5113 .3896 .6729 .5119 .5790 .4572 9 PHE 9 -.0559 .4845 999.9900 999.9900 .7573 .3953 .6697 .1051 .3403 .3921 10 MET 10 -.0824 -1.1064 999.9900 .9587 .5203 .0725 .6761 .5197 .5849 .2477 11 LYS 11 -.2345 -2.4344 999.9900 -.4035 .7460 -.5460 .4834 .1696 .3004 -.2967 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5335 -.3765 .0027 .2453 13 PHE 13 -.0400 -.0090 999.9900 999.9900 .7573 .2361 .6715 .1082 .3429 .2976 14 ILE 14 .2866 -1.9342 999.9900 999.9900 .6034 -.3481 .6614 .0456 .3022 -.0675 15 SER 15 .4640 999.9900 -.7153 999.9900 .6705 .1397 .6763 .5328 .5926 .3257 16 GLU 16 .1025 -1.9198 999.9900 .3501 .6899 -.1943 .6764 .5164 .5831 .0693 17 LYS 17 -.6960 -1.4228 999.9900 -.4035 .7460 -.4360 .6736 .1599 .3739 -.1923 18 SER 18 -.5255 999.9900 -.7153 999.9900 .6705 -.1901 .6726 .5318 .5905 .1268 19 SER 19 .9076 999.9900 .3727 999.9900 .6705 .6503 .6756 .5291 .5902 .6311 20 LYS 20 -3.5196 -1.9682 999.9900 -.0770 .7460 -.9792 .6752 .1578 .3734 -.5804 21 SER 21 .0280 999.9900 -.0289 999.9900 .6705 .2232 .6723 .5270 .5876 .3738 22 LEU 22 -.6702 -2.7185 999.9900 999.9900 .9565 -.8107 .6784 .1533 .3721 -.3201 23 GLU 23 -.4497 -.6022 999.9900 -1.0323 .6899 -.3486 .6761 .5227 .5866 -.0326 24 ILE 24 .2768 -1.4972 999.9900 999.9900 .6034 -.2057 .4769 .0447 .2248 -.0191 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5543 -.3753 .0120 .1602 26 LEU 26 .4996 -2.3037 999.9900 999.9900 .9565 -.2825 .6801 .1534 .3729 -.0028 27 GLY 27 .1734 999.9900 999.9900 999.9900 .7883 .4808 .5821 .4675 .5184 .5028 28 PHE 28 -1.3242 -4.3038 999.9900 999.9900 .7573 -1.6236 .6805 .1070 .3460 -.8166 29 ASN 29 .6990 -.7732 999.9900 999.9900 .7518 .2259 .6813 .3845 .5082 .3487 30 GLU 30 .0468 -2.1111 999.9900 -1.0323 .6899 -.6017 .6801 .5237 .5889 -.2005 31 TYR 31 .3338 -1.2913 999.9900 999.9900 .5630 -.1315 .6753 -.1641 .1857 .0233 32 PHE 32 -3.6149 -.5729 999.9900 999.9900 .7573 -1.1435 .4958 .1026 .2664 -.5664 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5503 -.3716 .0125 .2507 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4828 .3197 .3877 .2763 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5555 -.3781 .0109 .2617 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4945 .1054 .2675 -.2120 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5515 -.3738 .0117 .2038 38 ILE 38 -.1493 -1.3043 999.9900 999.9900 .6034 -.2834 .6666 .0326 .2967 -.0302 39 THR 39 -.5585 999.9900 -.8810 999.9900 .4476 -.3307 .6534 -.2524 .1250 -.1182 40 VAL 40 -.0582 999.9900 -.0276 999.9900 .7810 .2317 .6591 .1207 .3450 .2950 41 ASP 41 -.9509 -3.7306 999.9900 999.9900 .8104 -1.2904 .6789 .3901 .5104 -.5604 42 LEU 42 .0291 .5655 999.9900 999.9900 .9565 .5170 .6806 .1575 .3755 .4778 43 LEU 43 .0291 -3.3760 999.9900 999.9900 .9565 -.7968 .6751 .1637 .3768 -.3103 44 ASP 44 -1.5212 -2.0928 999.9900 999.9900 .8104 -.9345 .6756 .3753 .5004 -.3506 45 TYR 45 -3.1208 -4.1972 999.9900 999.9900 .5630 -2.2517 .6782 -.1648 .1865 -1.2483 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6746 .5313 .5910 -.5197 47 GLY 47 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5770 .4649 .5147 -.4140 48 ARG 48 -.4155 -.9796 999.9900 .7862 .8581 .2071 .6789 .5150 .5833 .3185 49 SER 49 .0374 999.9900 -.7153 999.9900 .6705 -.0025 .6771 .5327 .5929 .2405 50 TRP 50 -.1951 .0906 999.9900 999.9900 .9378 .2778 .6780 .1970 .3974 .3416 51 THR 51 .2423 999.9900 -.2947 999.9900 .4476 .1317 .6577 -.2758 .1132 .1554 52 VAL 52 -.0145 999.9900 -.5532 999.9900 .7810 .0711 .6625 .1179 .3448 .1988 53 ARG 53 -.5160 -2.3766 999.9900 .1593 .8581 -.3432 .6813 .5245 .5898 -.0729 54 MET 54 -.3206 .1064 999.9900 .9587 .5203 .3162 .6750 .5142 .5812 .4090 55 LYS 55 -.4529 -1.2293 999.9900 -.0770 .7460 -.2180 .6749 .1495 .3684 -.0380 56 LYS 56 -.1765 -1.2293 999.9900 .2495 .7460 -.0322 .6778 .1498 .3698 .0953 57 ARG 57 -.9010 -1.8960 999.9900 .7862 .8581 -.0733 .6715 .5268 .5871 .1188 58 GLY 58 -1.7786 999.9900 999.9900 999.9900 .7883 -.4952 .5848 .4710 .5216 .0164 59 GLU 59 -1.0162 -.0067 999.9900 -1.0323 .6899 -.3413 .6732 .5113 .5787 -.0301 60 LYS 60 -.1867 -2.4344 999.9900 -.4035 .7460 -.5364 .6835 .1546 .3750 -.2634 61 VAL 61 .5686 999.9900 -1.0788 999.9900 .7810 .0903 .6512 .1302 .3473 .2105 62 PHE 62 -.3916 -1.6624 999.9900 999.9900 .7573 -.4322 .6822 .1030 .3443 -.1023 63 LEU 63 -.2022 -2.5464 999.9900 999.9900 .9565 -.5973 .6722 .1652 .3764 -.1909 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6652 -.2416 .1363 -.8433 65 VAL 65 -1.2071 999.9900 -.5532 999.9900 .7810 -.3264 .6595 .1120 .3401 -.0416 66 GLY 66 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5899 .4795 .5286 -.1501 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6769 .1727 .3828 -.4582 68 GLU 68 .8604 -1.7714 999.9900 -1.0323 .6899 -.3134 .6776 .5239 .5880 -.0087 69 ASN 69 1.1117 -.6268 999.9900 999.9900 .7518 .4123 .6794 .3872 .5089 .4607 70 PHE 70 .6259 -3.6820 999.9900 999.9900 .7573 -.7663 .6767 .1142 .3486 -.3016 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6544 .1301 .3486 .2940 72 LYS 72 .6780 -1.2293 999.9900 -.0397 .7460 .0230 .6721 .1587 .3726 .1351 73 ASP 73 .9921 -3.7306 999.9900 999.9900 .8104 -.6427 .6759 .3712 .4981 -.1762 74 ASN 74 -.1320 -3.3254 999.9900 999.9900 .7518 -.9019 .6791 .3814 .5055 -.3290 75 ASN 75 -3.4329 -.5409 999.9900 999.9900 .7518 -1.0740 .6769 .3750 .5008 -.4340 76 LEU 76 -3.3085 -2.5464 999.9900 999.9900 .9565 -1.6328 .6840 .1379 .3655 -.8153 77 GLU 77 -1.3743 -1.5476 999.9900 -1.0323 .6899 -.8161 .6736 .5213 .5848 -.3449 78 ASP 78 -1.5212 -1.5978 999.9900 999.9900 .8104 -.7695 .6708 .3717 .4964 -.2532 79 GLY 79 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5888 .4837 .5304 -.4064 80 LYS 80 -.7069 .2033 999.9900 -.4035 .7460 -.1129 .6768 .1627 .3769 .0393 81 TYR 81 .2346 -4.1972 999.9900 999.9900 .5630 -1.1332 .6749 -.1739 .1798 -.5797 82 LEU 82 -.3571 .5521 999.9900 999.9900 .9565 .3838 .6752 .1603 .3749 .3974 83 GLN 83 -.1966 -2.6982 999.9900 1.3059 .5113 -.2694 .6756 .5163 .5827 .0191 84 PHE 84 -.2457 -4.3038 999.9900 999.9900 .7573 -1.2641 .6789 .1028 .3428 -.6021 85 ILE 85 .2768 -.7023 999.9900 999.9900 .6034 .0593 .6644 .0356 .2976 .1756 86 TYR 86 .4225 -1.3592 999.9900 999.9900 .5630 -.1246 .6730 -.1909 .1691 .0217 87 ASP 87 -1.9993 -.4675 999.9900 999.9900 .8104 -.5521 .6834 .3834 .5084 -.1179 88 ARG 88 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .6777 .5222 .5870 -.4867 89 ASP 89 -3.3417 -1.7735 999.9900 999.9900 .8104 -1.4349 .6723 .3723 .4973 -.6520 90 ARG 90 -2.5097 -2.8571 999.9900 .1593 .8581 -.8380 .6769 .5253 .5885 -.4268 91 THR 91 .1734 999.9900 -.8810 999.9900 .4476 -.0867 .6542 -.2609 .1204 .0267 92 PHE 92 .0629 .0765 999.9900 999.9900 .7573 .2989 .6763 .1111 .3466 .3368 93 TYR 93 .3730 -1.6488 999.9900 999.9900 .5630 -.2376 .6749 -.1749 .1792 -.0426 94 VAL 94 -1.1939 999.9900 .5873 999.9900 .7810 .0581 .6531 .1295 .3477 .1914 95 ILE 95 -.6753 .9074 999.9900 999.9900 .6034 .2785 .6541 .0446 .2986 .3068 96 ILE 96 .3059 -1.1192 999.9900 999.9900 .6034 -.0700 .6586 .0490 .3030 .0995 97 TYR 97 -.0495 .8463 999.9900 999.9900 .5630 .4532 .6760 -.1680 .1837 .3735 98 GLY 98 -.2090 999.9900 999.9900 999.9900 .7883 .2896 .5759 .4701 .5171 .4063 99 HIS 99 -3.0884 -1.3248 999.9900 999.9900 .6686 -1.2482 .6788 .3196 .4693 -.5492 100 ASN 100 -1.1452 -.5009 999.9900 999.9900 .7518 -.2981 .6750 .3781 .5018 .0318 101 MET 101 -.5049 -.9517 999.9900 .9587 .5203 .0056 .6814 .5211 .5879 .2042 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6740 .2316 .4212 .3451 Means: -.6612 -1.5824 -.4981 .0761 .7095 -.3358 .6521 .2116 .3960 -.0405 2.00 analyzed_10