1 ASP 1 999.9900 -.4551 999.9900 999.9900 .6310 .0879 .3427 -.2672 .0100 .0628 2 PRO 2 -.7236 999.9900 999.9900 999.9900 .2426 -.2405 .4922 -.2080 .0838 -.0492 3 ASN 3 .0457 .2165 999.9900 999.9900 .3127 .1916 -.0799 -.2868 -.2006 .0416 4 ALA 4 -1.9992 999.9900 999.9900 999.9900 .1657 -.9168 -.1474 .4309 .1899 -.3875 5 GLU 5 -.4325 -.3402 999.9900 .3501 .5923 .0424 -.7029 .6043 .0596 .0118 6 PHE 6 -.8715 .2875 999.9900 999.9900 .2172 -.1222 -.1864 .6145 .2808 .0123 7 ASP 7 -1.4736 -1.2276 999.9900 999.9900 -.4783 -1.0598 .3816 -.1106 .0945 -.5817 8 PRO 8 .0709 999.9900 999.9900 999.9900 .4021 .2365 .5514 .2594 .3810 .3209 9 ASP 9 -.4109 -.7325 999.9900 999.9900 .5733 -.1900 .4156 .5105 .4710 .0712 10 LEU 10 -.1775 -1.6462 999.9900 999.9900 .4774 -.4488 .4084 .4556 .4359 -.0965 11 PRO 11 -.0828 999.9900 999.9900 999.9900 .4949 .2061 .5849 .3999 .4770 .3492 12 GLY 12 .8874 999.9900 999.9900 999.9900 -.0291 .4291 .4827 .5740 .5334 .4787 13 GLY 13 .3568 999.9900 999.9900 999.9900 -.0631 .1469 .5929 .4830 .5318 .3424 14 GLY 14 .8169 999.9900 999.9900 999.9900 -.0631 .3769 .3783 .6994 .5567 .4579 15 LEU 15 -.4552 .8730 999.9900 999.9900 .5293 .3157 .0145 .6307 .3740 .3185 16 HIS 16 -1.2838 .8438 999.9900 999.9900 .1122 -.1093 -.5578 .3331 -.0381 -.1105 17 ARG 17 -.1504 -.4122 999.9900 1.3169 -2.3710 -.0600 -1.3452 .3976 -.3285 -.1782 18 CYS 18 .0411 999.9900 .1296 999.9900 -.3261 -.0518 -.1954 .3107 .0999 -.0080 19 LEU 19 1.1349 .5315 999.9900 999.9900 .6486 .7716 .2357 .3964 .3294 .5894 20 ALA 20 .8001 999.9900 999.9900 999.9900 .8152 .8077 .4232 .6056 .5296 .6610 21 CYS 21 -.1164 999.9900 .1296 999.9900 .9108 .3080 .3541 .2235 .2780 .3003 22 ALA 22 -2.2093 999.9900 999.9900 999.9900 -.1496 -1.1795 .3232 .4445 .3939 -.3978 23 ARG 23 -.5614 .1897 999.9900 1.3917 .8581 .6539 -1.2062 .4730 -.2266 .3624 24 TYR 24 -.0390 .2608 999.9900 999.9900 .2066 .1428 -1.9948 .0868 -.7805 -.2959 25 PHE 25 .0629 -1.1403 999.9900 999.9900 .4513 -.2087 -.0384 .4980 .2745 -.0333 26 ILE 26 .4667 -.4893 999.9900 999.9900 -1.0155 -.3460 .3606 .2996 .3251 -.0756 27 ASP 27 -.6293 -1.1062 999.9900 999.9900 .4469 -.4295 .6164 .4593 .5248 -.0426 28 SER 28 .8760 999.9900 -.0289 999.9900 -.0193 .2759 .5872 .4384 .5004 .3707 29 THR 29 1.1372 999.9900 -.2947 999.9900 .1092 .3173 -.5790 .3184 -.0555 .1382 30 ASN 30 1.3908 -.2921 999.9900 999.9900 -.5831 .1719 -.2091 .3457 .1146 .1305 31 LEU 31 .2902 -2.0611 999.9900 999.9900 .2713 -.4998 -1.6946 .4381 -.4505 -.5512 32 LYS 32 1.2214 .7597 999.9900 1.6528 -.8987 .8776 .6314 .5042 .5572 .7891 33 THR 33 .7717 999.9900 .0483 999.9900 .1092 .3098 .4617 .5038 .4863 .3790 34 HIS 34 1.4298 -.2881 999.9900 999.9900 .5967 .5795 .1387 .4280 .3075 .4610 35 PHE 35 -1.3242 -.0015 999.9900 999.9900 .7193 -.2021 .6072 .0060 .2565 .0014 36 ARG 36 -.4248 1.0644 999.9900 .1593 -1.3564 -.0796 .4924 .4736 .4814 .0811 37 SER 37 -2.2020 999.9900 .3727 999.9900 .3749 -.4848 .1518 .5843 .4041 -.1437 38 LYS 38 1.2214 .8340 999.9900 .9398 .1791 .8229 .3823 .5242 .4651 .7173 39 ASP 39 1.1359 -2.4630 999.9900 999.9900 .5431 -.2613 .6328 .4520 .5273 .0602 40 HIS 40 .8901 -1.3248 999.9900 999.9900 .5967 .0540 -3.1384 .4906 -1.0215 -.4972 41 LYS 41 .6780 .7798 999.9900 .6177 -2.6618 .0063 -.6174 -.5264 -.5643 -.1589 42 LYS 42 1.0838 .8340 999.9900 .1731 -.3378 .3852 .2951 .5746 .4582 .3994 43 ARG 43 .6041 -.2494 999.9900 .7862 .5640 .4982 .0261 .4796 .2906 .4281 44 LEU 44 .8442 .8847 999.9900 999.9900 .4227 .7172 -.0019 .5961 .3469 .5492 45 LYS 45 .6780 1.1488 999.9900 -.4035 -.3378 .1364 .6793 .5732 .6175 .2764 46 GLN 46 .6461 1.1250 999.9900 1.3059 .6605 .9344 .6937 .6317 .6575 .8438 47 LEU 47 -.2213 .5315 999.9900 999.9900 .4774 .2625 .6478 .4141 .5115 .3699 48 SER 48 -3.7598 999.9900 .3727 999.9900 .3088 -1.0261 .6296 -.1077 .1995 -.5113 49 VAL 49 .3707 999.9900 .8662 999.9900 .8778 .7049 .4354 .4404 .4383 .5981 50 GLU 50 -3.2255 .6046 999.9900 -1.0323 -.3984 -1.0129 .5789 .3001 .4163 -.5288 51 PRO 51 -.9386 999.9900 999.9900 999.9900 .4496 -.2445 .4897 .4625 .4738 .1158 52 TYR 52 -.7539 -.4266 999.9900 999.9900 .2769 -.3012 .1682 .4206 .3155 -.0629 53 SER 53 -1.8383 999.9900 .3727 999.9900 .5740 -.2972 .4741 .5417 .5135 .0248 54 GLN 54 -3.1236 .2375 999.9900 1.3059 .6133 -.2418 -.2539 .0879 -.0545 -.1888 55 GLU 55 -3.2255 -.3559 999.9900 -1.0323 .4218 -1.0480 -.6177 .0353 -.2368 -.7957 56 GLU 56 -.6642 1.2631 999.9900 -1.0323 -.1261 -.1399 .0795 .5440 .3505 .0107 57 ALA 57 -2.0946 999.9900 999.9900 999.9900 -.0105 -1.0526 -.1662 .4445 .1900 -.4567 58 GLU 58 -.7734 1.1195 999.9900 -1.0323 .6424 -.0109 .3356 .6991 .5476 .1651 59 ARG 59 -.5855 -.0184 999.9900 .1593 .1299 -.0311 -.0031 .6725 .3910 .0734 60 ALA 60 -1.4499 999.9900 999.9900 999.9900 .7881 -.3309 .3299 .5729 .4717 .0602 61 ALA 61 -3.4646 999.9900 999.9900 999.9900 .7881 -1.3383 -.0822 .4644 .2367 -.5736 62 GLY 62 -3.4864 999.9900 999.9900 999.9900 .8897 -1.2983 .1599 .6100 .4100 -.4567 63 MET 63 -1.1708 .5321 999.9900 .9587 -.3043 .0039 .3327 .6786 .5345 .1712 64 GLY 64 -1.6434 999.9900 999.9900 999.9900 .6270 -.5082 .3877 .5710 .4896 -.0144 65 SER 65 -2.9368 999.9900 .6576 999.9900 -1.1621 -1.1471 .1564 .4361 .3195 -.5698 66 TYR 66 -1.5571 -1.2283 999.9900 999.9900 .7784 -.6690 -.0782 .4652 .2388 -.3240 67 VAL 67 999.9900 999.9900 .6672 999.9900 999.9900 .6672 .3580 .4757 .4253 .5003 Means: -.5004 -.0326 .2994 .4778 .1543 -.0332 .0589 .3904 .2515 .0689 2.00 refined_19