1 MET 1 999.9900 -2.5481 999.9900 .9587 .5203 -.3564 .6684 .4947 .5736 .0188 2 ALA 2 -1.9174 999.9900 999.9900 999.9900 .7458 -.5858 .6638 .3192 .4628 -.0471 3 ASP 3 -1.8260 -2.6388 999.9900 999.9900 .8104 -1.2181 .6779 .3801 .5042 -.5193 4 THR 4 -.3004 999.9900 -.2947 999.9900 .4476 -.0492 .6558 -.2647 .1189 .0487 5 GLY 5 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .5735 .4632 .5122 .3100 6 GLU 6 -3.2255 -1.9198 999.9900 .3501 .6899 -1.0263 .6779 .5211 .5865 -.4844 7 VAL 7 .0764 999.9900 -.2457 999.9900 .7810 .2039 .6576 .1235 .3461 .2786 8 GLN 8 -.3854 -.0435 999.9900 1.3059 .5113 .3471 .6757 .5158 .5824 .4300 9 PHE 9 -.6363 -.4306 999.9900 999.9900 .7573 -.1032 .6807 .1060 .3454 .0954 10 MET 10 -.1559 -2.0676 999.9900 .9587 .5203 -.1861 .6753 .5183 .5837 .0749 11 LYS 11 -.6340 -2.4344 999.9900 .3240 .7460 -.3348 .4960 .1693 .3054 -.1441 12 PRO 12 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5497 -.3893 .0020 .2461 13 PHE 13 .0900 .0697 999.9900 999.9900 .7573 .3057 .6769 .1043 .3429 .3397 14 ILE 14 .1597 -2.4201 999.9900 999.9900 .6034 -.5523 .6631 .0544 .3081 -.1879 15 SER 15 .1589 999.9900 .6576 999.9900 .6705 .4957 .6718 .5306 .5895 .5379 16 GLU 16 1.0761 -.4051 999.9900 -1.0323 .6899 .0821 .6750 .5174 .5831 .2535 17 LYS 17 -2.0221 -1.8181 999.9900 -.0397 .7460 -.6347 .6765 .1462 .3672 -.3359 18 SER 18 -.6212 999.9900 -.7153 999.9900 .6705 -.2220 .6811 .5324 .5943 .1095 19 SER 19 .1589 999.9900 -.7153 999.9900 .6705 .0380 .6809 .5397 .5985 .2669 20 LYS 20 -3.5196 -1.6955 999.9900 -.4035 .7460 -1.0552 .6692 .1507 .3667 -.6366 21 SER 21 -.6802 999.9900 -.7153 999.9900 .6705 -.2417 .6771 .5312 .5920 .0967 22 LEU 22 .1006 -2.3037 999.9900 999.9900 .9565 -.4155 .6720 .1445 .3643 -.0860 23 GLU 23 -.6642 -.2267 999.9900 -1.0323 .6899 -.3083 .6813 .5293 .5926 -.0038 24 ILE 24 -.1408 -.1188 999.9900 999.9900 .6034 .1146 .4771 .0471 .2262 .1736 25 PRO 25 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5341 -.3631 .0107 .1581 26 LEU 26 -1.3832 -3.3760 999.9900 999.9900 .9565 -1.2676 .6756 .1614 .3757 -.5931 27 GLY 27 .0582 999.9900 999.9900 999.9900 .7883 .4232 .5763 .4796 .5226 .4756 28 PHE 28 -.5116 -1.0172 999.9900 999.9900 .7573 -.2572 .6758 .1130 .3475 .0035 29 ASN 29 .1294 -1.3461 999.9900 999.9900 .7518 -.1550 .6784 .3749 .5014 .1177 30 GLU 30 .4426 -1.9198 999.9900 -1.0323 .6899 -.4549 .6785 .5260 .5895 -.1025 31 TYR 31 -.2520 -4.1972 999.9900 999.9900 .5630 -1.2954 .6761 -.1677 .1839 -.6756 32 PHE 32 -3.6149 .1164 999.9900 999.9900 .7573 -.9137 .4814 .0988 .2582 -.4322 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5575 -.3551 .0251 .2566 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4826 .3229 .3895 .2770 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5391 -.3739 .0065 .2586 36 PHE 36 -1.5081 -.9090 999.9900 999.9900 .7573 -.5533 .4885 .0967 .2600 -.2149 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5492 -.3640 .0165 .2057 38 ILE 38 -2.8303 -.5232 999.9900 999.9900 .6034 -.9167 .6538 .0580 .3063 -.4077 39 THR 39 .0643 999.9900 -.8810 999.9900 .4476 -.1231 .6605 -.2672 .1193 .0048 40 VAL 40 -.0582 999.9900 -.2457 999.9900 .7810 .1590 .6589 .1297 .3502 .2532 41 ASP 41 -1.2415 -.6983 999.9900 999.9900 .8104 -.3764 .6697 .3693 .4945 -.0181 42 LEU 42 -.4930 -.1732 999.9900 999.9900 .9565 .0968 .6728 .1440 .3644 .2214 43 LEU 43 -.6830 -2.9612 999.9900 999.9900 .9565 -.8959 .6781 .1454 .3674 -.3728 44 ASP 44 -1.3105 .1557 999.9900 999.9900 .8104 -.1148 .6774 .3856 .5072 .1437 45 TYR 45 -3.6999 -4.1972 999.9900 999.9900 .5630 -2.4447 .6749 -.1858 .1728 -1.3690 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6793 .5326 .5937 -.5186 47 GLY 47 -2.1575 999.9900 999.9900 999.9900 .7883 -.6846 .5723 .4570 .5082 -.0850 48 ARG 48 -.6502 -1.1946 999.9900 .5548 .8581 .0246 .6714 .5191 .5826 .1876 49 SER 49 -.5771 999.9900 -.7153 999.9900 .6705 -.2073 .6790 .5383 .5969 .1190 50 TRP 50 -.3875 -.4963 999.9900 999.9900 .9378 .0180 .6714 .1809 .3853 .1812 51 THR 51 .1937 999.9900 -.8810 999.9900 .4476 -.0799 .6571 -.2458 .1304 .0343 52 VAL 52 -.0145 999.9900 -.0276 999.9900 .7810 .2463 .6564 .1184 .3426 .3028 53 ARG 53 -.4063 -1.7413 999.9900 .1593 .8581 -.1942 .6798 .5148 .5836 .0320 54 MET 54 -.3206 .1064 999.9900 .9587 .5203 .3162 .6808 .5210 .5876 .4111 55 LYS 55 -.1715 .2033 999.9900 .1731 .7460 .2248 .6734 .1524 .3695 .2785 56 LYS 56 -.1765 -.8858 999.9900 -.4035 .7460 -.2247 .6800 .1542 .3733 -.0413 57 ARG 57 -1.7561 -2.0954 999.9900 .1593 .8581 -.5350 .6695 .5169 .5805 -.2126 58 GLY 58 -1.4779 999.9900 999.9900 999.9900 .7883 -.3448 .5804 .4597 .5134 .0876 59 GLU 59 -.7734 -1.3804 999.9900 -1.0323 .6899 -.6241 .6768 .5142 .5819 -.2176 60 LYS 60 -.1765 -2.4344 999.9900 .6506 .7460 -.1127 .6771 .1574 .3739 .0387 61 VAL 61 -.0463 999.9900 -.2457 999.9900 .7810 .1630 .6587 .1195 .3442 .2534 62 PHE 62 -.3916 -.1815 999.9900 999.9900 .7573 .0614 .6828 .0971 .3412 .1928 63 LEU 63 -.7510 -2.5464 999.9900 999.9900 .9565 -.7803 .6781 .1659 .3794 -.2994 64 THR 64 -4.2065 999.9900 -.8810 999.9900 .4476 -1.5467 .6631 -.2740 .1165 -.8502 65 VAL 65 -1.2071 999.9900 -1.0788 999.9900 .7810 -.5016 .6574 .1116 .3390 -.1472 66 GLY 66 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5871 .4795 .5273 -.2794 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6754 .1815 .3873 -.4567 68 GLU 68 .6116 -2.3808 999.9900 -1.0323 .6899 -.5279 .6849 .5302 .5947 -.1494 69 ASN 69 1.3908 .7079 999.9900 999.9900 .7518 .9502 .6761 .3819 .5045 .7817 70 PHE 70 .6259 -1.6624 999.9900 999.9900 .7573 -.0931 .6754 .1063 .3434 .1005 71 VAL 71 1.0462 999.9900 -1.0788 999.9900 .7810 .2495 .6552 .1249 .3459 .3057 72 LYS 72 .6780 -.4721 999.9900 -.4035 .7460 .0290 .6737 .1519 .3694 .1387 73 ASP 73 .9921 -1.1348 999.9900 999.9900 .8104 .2226 .6827 .3812 .5068 .3463 74 ASN 74 -.1320 -2.0766 999.9900 999.9900 .7518 -.4856 .6769 .3784 .5028 -.0803 75 ASN 75 -3.4329 -.5409 999.9900 999.9900 .7518 -1.0740 .6764 .3749 .5005 -.4341 76 LEU 76 -3.7702 -2.5464 999.9900 999.9900 .9565 -1.7867 .6822 .1469 .3699 -.9062 77 GLU 77 -1.3743 -2.8418 999.9900 .3501 .6899 -.7940 .6732 .5251 .5868 -.3296 78 ASP 78 -1.0430 .2812 999.9900 999.9900 .8104 .0162 .6750 .3780 .5018 .2203 79 GLY 79 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5798 .4666 .5169 -.4129 80 LYS 80 -.7762 .6283 999.9900 -.4035 .7460 -.0418 .6784 .1643 .3785 .0905 81 TYR 81 .4225 -.3906 999.9900 999.9900 .5630 .1983 .6706 -.1925 .1671 .2146 82 LEU 82 .0291 -1.7966 999.9900 999.9900 .9565 -.2704 .6825 .1553 .3749 .0053 83 GLN 83 -.1966 .2203 999.9900 2.7911 .5113 .8315 .6797 .5241 .5890 .7550 84 PHE 84 -.2457 -.6014 999.9900 999.9900 .7573 -.0299 .6776 .0892 .3344 .1354 85 ILE 85 .3543 -1.7901 999.9900 999.9900 .6034 -.2775 .6584 .0276 .2905 -.0293 86 TYR 86 .0406 -.3337 999.9900 999.9900 .5630 .0900 .6798 -.1642 .1875 .1571 87 ASP 87 -1.6275 -1.0260 999.9900 999.9900 .8104 -.6144 .6799 .3866 .5088 -.1553 88 ARG 88 -2.0927 -.8157 999.9900 .1593 .8581 -.3463 .6773 .5102 .5799 -.0777 89 ASP 89 -2.8635 -1.5978 999.9900 999.9900 .8104 -1.2170 .6780 .3748 .5011 -.5196 90 ARG 90 -1.1554 -1.8960 999.9900 .6901 .8581 -.1626 .6782 .5085 .5792 .0534 91 THR 91 .3363 999.9900 .0483 999.9900 .4476 .2774 .6621 -.2518 .1290 .2485 92 PHE 92 .1161 -.6612 999.9900 999.9900 .7573 .0707 .6767 .0948 .3372 .1967 93 TYR 93 .0686 .2551 999.9900 999.9900 .5630 .2956 .6808 -.1907 .1724 .2754 94 VAL 94 -1.1939 999.9900 -1.0788 999.9900 .7810 -.4972 .6577 .1230 .3458 -.1422 95 ILE 95 -1.5441 -.0236 999.9900 999.9900 .6034 -.3214 .6631 .0525 .3070 -.0497 96 ILE 96 .2593 -2.1272 999.9900 999.9900 .6034 -.4215 .6550 .0358 .2938 -.1147 97 TYR 97 -.1387 -.1547 999.9900 999.9900 .5630 .0898 .6698 -.1775 .1755 .1523 98 GLY 98 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5879 .4680 .5213 -.2069 99 HIS 99 -3.0884 -.8163 999.9900 999.9900 .6686 -1.0787 .6804 .3226 .4717 -.4466 100 ASN 100 -1.5699 -2.3357 999.9900 999.9900 .7518 -1.0513 .6808 .3834 .5073 -.4179 101 MET 101 -2.6662 -2.5481 999.9900 .9587 .5203 -.9338 .6835 .5197 .5880 -.4220 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6799 .2443 .4310 .3513 Means: -.8244 -1.2834 -.5095 .1514 .7095 -.3143 .6522 .2105 .3954 -.0275 2.00 analyzed_18