1 MET 1 999.9900 -2.0676 999.9900 .9587 .5203 -.1962 .6757 .5014 .5807 .1177 2 ALA 2 -.5338 999.9900 999.9900 999.9900 .7458 .1060 .6637 .3169 .4614 .2982 3 ASP 3 -2.8635 -1.0518 999.9900 999.9900 .8104 -1.0350 .6775 .3843 .5065 -.4086 4 THR 4 -.2485 999.9900 .7650 999.9900 .4476 .3214 .6574 -.2643 .1198 .2715 5 GLY 5 -1.3427 999.9900 999.9900 999.9900 .7883 -.2772 .5764 .4809 .5233 .1257 6 GLU 6 -3.2255 -2.8418 999.9900 -1.0323 .6899 -1.6024 .6797 .5248 .5893 -.8675 7 VAL 7 .0815 999.9900 -.5532 999.9900 .7810 .1031 .6578 .1233 .3460 .2181 8 GLN 8 -.4791 -.2905 999.9900 1.3059 .5113 .2619 .6820 .5215 .5884 .3752 9 PHE 9 -.1228 -.6160 999.9900 999.9900 .7573 .0062 .6739 .0898 .3332 .1564 10 MET 10 -.3815 -.7698 999.9900 .9587 .5203 .0819 .6755 .5116 .5799 .2525 11 LYS 11 -.8267 -1.1257 999.9900 -.0397 .7460 -.2572 .5041 .1569 .3015 -.0893 12 PRO 12 .0120 999.9900 999.9900 999.9900 .4496 .2308 .5484 -.3644 .0159 .1614 13 PHE 13 .0490 -4.3038 999.9900 999.9900 .7573 -1.1658 .6772 .0977 .3391 -.5445 14 ILE 14 -.1796 -.8802 999.9900 999.9900 .6034 -.1521 .6633 .0457 .3030 .0505 15 SER 15 .1386 999.9900 -.7153 999.9900 .6705 .0313 .6734 .5393 .5952 .2613 16 GLU 16 .1025 -2.3808 999.9900 -1.0323 .6899 -.6552 .6760 .5176 .5836 -.2378 17 LYS 17 -.8267 -1.5020 999.9900 -.4035 .7460 -.4780 .6764 .1464 .3672 -.2239 18 SER 18 -.6212 999.9900 -.7153 999.9900 .6705 -.2220 .6798 .5298 .5923 .1087 19 SER 19 .1589 999.9900 -.7153 999.9900 .6705 .0380 .6780 .5432 .5994 .2671 20 LYS 20 -3.5196 -1.5020 999.9900 -.4035 .7460 -1.0165 .6764 .1619 .3763 -.6063 21 SER 21 .0184 999.9900 -.7153 999.9900 .6705 -.0088 .6737 .5306 .5902 .2356 22 LEU 22 .0986 -1.0979 999.9900 999.9900 .9565 -.0143 .6843 .1541 .3751 .1591 23 GLU 23 -.3890 -2.8418 999.9900 -1.0323 .6899 -.8933 .6830 .5182 .5869 -.3953 24 ILE 24 .2593 -.1471 999.9900 999.9900 .6034 .2385 .4650 .0543 .2255 .2470 25 PRO 25 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5439 -.3716 .0099 .2604 26 LEU 26 .8475 -2.9612 999.9900 999.9900 .9565 -.3857 .6760 .1487 .3684 -.0665 27 GLY 27 .7440 999.9900 999.9900 999.9900 .7883 .7661 .5867 .4784 .5265 .6493 28 PHE 28 .6259 -1.2232 999.9900 999.9900 .7573 .0533 .6736 .0981 .3379 .1863 29 ASN 29 1.3908 -1.2512 999.9900 999.9900 .7518 .2972 .6766 .3809 .5041 .3898 30 GLU 30 .0468 -1.1358 999.9900 1.1588 .6899 .1899 .6742 .5261 .5878 .3267 31 TYR 31 .3338 -4.1972 999.9900 999.9900 .5630 -1.1002 .6765 -.1845 .1742 -.5617 32 PHE 32 -3.6149 -.4925 999.9900 999.9900 .7573 -1.1167 .4871 .1059 .2647 -.5514 33 PRO 33 .3744 999.9900 999.9900 999.9900 .4496 .4120 .5546 -.3849 .0065 .2484 34 ALA 34 -.4433 999.9900 999.9900 999.9900 .7458 .1513 .4897 .3269 .3947 .2798 35 PRO 35 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5580 -.3672 .0183 .2650 36 PHE 36 -1.5081 -.7766 999.9900 999.9900 .7573 -.5091 .4940 .1055 .2674 -.1856 37 PRO 37 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5559 -.3747 .0131 .2047 38 ILE 38 -1.4718 -.1188 999.9900 999.9900 .6034 -.3291 .6579 .0429 .2992 -.0573 39 THR 39 -.8088 999.9900 -.8810 999.9900 .4476 -.4141 .6562 -.2428 .1318 -.1658 40 VAL 40 -.0523 999.9900 .4980 999.9900 .7810 .4089 .6553 .1340 .3512 .4032 41 ASP 41 -.7969 -1.0260 999.9900 999.9900 .8104 -.3375 .6793 .3814 .5055 .0096 42 LEU 42 -.3571 -.0413 999.9900 999.9900 .9565 .1860 .6809 .1590 .3764 .2796 43 LEU 43 -.1655 -1.4996 999.9900 999.9900 .9565 -.2362 .6765 .1607 .3756 .0257 44 ASP 44 -1.5212 -2.4630 999.9900 999.9900 .8104 -1.0579 .6780 .3856 .5074 -.4220 45 TYR 45 -3.6999 -.9448 999.9900 999.9900 .5630 -1.3606 .6789 -.1687 .1845 -.7143 46 SER 46 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6693 .5227 .5838 -.5225 47 GLY 47 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .5815 .4746 .5221 -.1535 48 ARG 48 -.5733 -2.3766 999.9900 1.0005 .8581 -.0181 .6791 .5249 .5891 .1590 49 SER 49 .0374 999.9900 -.0289 999.9900 .6705 .2264 .6799 .5354 .5956 .3789 50 TRP 50 -.1951 -.6490 999.9900 999.9900 .9378 .0312 .6742 .2001 .3976 .1936 51 THR 51 .4171 999.9900 -.8810 999.9900 .4476 -.0055 .6606 -.2576 .1250 .0773 52 VAL 52 -.0145 999.9900 -1.0788 999.9900 .7810 -.1041 .6591 .1205 .3449 .0935 53 ARG 53 -.4063 -2.0954 999.9900 .1593 .8581 -.2650 .6679 .5153 .5789 -.0202 54 MET 54 -.2651 -.2630 999.9900 .9587 .5203 .2377 .6781 .5197 .5857 .3581 55 LYS 55 -.3223 -2.1617 999.9900 -.0770 .7460 -.3784 .6794 .1515 .3715 -.1516 56 LYS 56 -.1765 -2.1617 999.9900 .1140 .7460 -.2728 .6736 .1706 .3802 -.0743 57 ARG 57 -1.5415 -1.1946 999.9900 .6901 .8581 -.0996 .6760 .5102 .5793 .0983 58 GLY 58 -1.2645 999.9900 999.9900 999.9900 .7883 -.2381 .5875 .4820 .5289 .1483 59 GLU 59 -1.0162 -2.8418 999.9900 -1.0323 .6899 -1.0501 .6734 .5181 .5828 -.5015 60 LYS 60 -.2075 -.9566 999.9900 .4411 .7460 .0928 .6735 .1537 .3703 .1845 61 VAL 61 .0429 999.9900 .6672 999.9900 .7810 .4971 .6563 .1254 .3466 .4546 62 PHE 62 -.1316 -.1815 999.9900 999.9900 .7573 .1481 .6743 .0916 .3344 .2420 63 LEU 63 -.1836 -2.5464 999.9900 999.9900 .9565 -.5912 .6739 .1477 .3669 -.1904 64 THR 64 -3.2663 999.9900 -.8810 999.9900 .4476 -1.2333 .6620 -.2608 .1237 -.6597 65 VAL 65 -1.2071 999.9900 -1.0788 999.9900 .7810 -.5016 .6573 .1199 .3438 -.1455 66 GLY 66 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .5862 .4714 .5224 -.2064 67 TRP 67 -.6924 -3.3859 999.9900 999.9900 .9378 -1.0468 .6753 .1865 .3901 -.4557 68 GLU 68 .6833 -.8169 999.9900 .3501 .6899 .2266 .6729 .5265 .5875 .3510 69 ASN 69 .9642 -.7732 999.9900 999.9900 .7518 .3143 .6782 .3879 .5089 .4018 70 PHE 70 .8041 -1.4162 999.9900 999.9900 .7573 .0484 .6754 .0852 .3311 .1812 71 VAL 71 .9834 999.9900 -1.0788 999.9900 .7810 .2286 .6640 .1232 .3485 .2946 72 LYS 72 .6780 -1.4228 999.9900 -.4035 .7460 -.1612 .6815 .1569 .3755 .0047 73 ASP 73 .9921 -2.8653 999.9900 999.9900 .8104 -.3543 .6782 .3787 .5035 -.0012 74 ASN 74 .2400 -1.2512 999.9900 999.9900 .7518 -.0864 .6719 .3724 .4972 .1570 75 ASN 75 -3.4329 -.0252 999.9900 999.9900 .7518 -.9021 .6762 .3850 .5063 -.3290 76 LEU 76 -.7369 -.4539 999.9900 999.9900 .9565 -.0781 .6753 .1623 .3761 .1207 77 GLU 77 -1.3743 -2.8418 999.9900 .3501 .6899 -.7940 .6772 .5193 .5851 -.3299 78 ASP 78 -1.5212 -2.8653 999.9900 999.9900 .8104 -1.1920 .6734 .3816 .5032 -.5042 79 GLY 79 -2.9723 999.9900 999.9900 999.9900 .7883 -1.0920 .5936 .4786 .5297 -.2780 80 LYS 80 -.7069 -1.2293 999.9900 -.4035 .7460 -.3994 .6780 .1678 .3804 -.1645 81 TYR 81 .4043 .0738 999.9900 999.9900 .5630 .3470 .6813 -.1722 .1834 .3100 82 LEU 82 -.5178 -2.7185 999.9900 999.9900 .9565 -.7599 .6754 .1697 .3804 -.2869 83 GLN 83 -.1966 -2.6982 999.9900 1.3059 .5113 -.2694 .6732 .5209 .5844 .0194 84 PHE 84 -.2457 .0765 999.9900 999.9900 .7573 .1961 .6726 .1042 .3410 .2730 85 ILE 85 .1597 -3.0500 999.9900 999.9900 .6034 -.7623 .6547 .0479 .3007 -.3169 86 TYR 86 .2346 -.3789 999.9900 999.9900 .5630 .1395 .6738 -.1860 .1722 .1813 87 ASP 87 -2.2314 -2.8653 999.9900 999.9900 .8104 -1.4288 .6709 .3721 .4966 -.6487 88 ARG 88 -2.5097 -1.6149 999.9900 .1593 .8581 -.5896 .6814 .5123 .5827 -.2506 89 ASP 89 -2.3854 -1.1646 999.9900 999.9900 .8104 -.9132 .6802 .3872 .5093 -.3344 90 ARG 90 -1.6758 -.3726 999.9900 .1593 .8581 -.1743 .6804 .5211 .5875 .0471 91 THR 91 .3017 999.9900 -.8810 999.9900 .4476 -.0439 .6590 -.2448 .1318 .0565 92 PHE 92 .0629 -1.2232 999.9900 999.9900 .7573 -.1343 .6785 .1123 .3482 .0776 93 TYR 93 .3730 .5582 999.9900 999.9900 .5630 .4981 .6739 -.1771 .1775 .3982 94 VAL 94 -.3909 999.9900 -1.0788 999.9900 .7810 -.2295 .6488 .1202 .3404 .0161 95 ILE 95 -1.5441 -3.0500 999.9900 999.9900 .6034 -1.3302 .6636 .0296 .2938 -.6595 96 ILE 96 .2593 -1.2277 999.9900 999.9900 .6034 -.1217 .6556 .0467 .3004 .0674 97 TYR 97 .0017 .8258 999.9900 999.9900 .5630 .4635 .6723 -.1845 .1725 .3757 98 GLY 98 -.7321 999.9900 999.9900 999.9900 .7883 .0281 .5884 .4759 .5259 .2801 99 HIS 99 -3.0884 -.1263 999.9900 999.9900 .6686 -.8487 .6748 .3166 .4659 -.3109 100 ASN 100 -2.3558 -2.0766 999.9900 999.9900 .7518 -1.2269 .6768 .3791 .5032 -.5249 101 MET 101 -2.6662 -2.5481 999.9900 .9587 .5203 -.9338 .6846 .5213 .5893 -.4216 102 CYS 102 999.9900 999.9900 .1296 999.9900 999.9900 .1296 .6792 .2481 .4328 .3523 Means: -.6769 -1.4769 -.5231 .1580 .7095 -.3101 .6526 .2122 .3965 -.0244 2.00 analyzed_19