1 ASP 1 999.9900 -3.7306 999.9900 999.9900 .8104 -1.4601 .5018 .3601 .4245 -.5146 2 PRO 2 .1879 999.9900 999.9900 999.9900 .4496 .3188 .5466 -.3673 .0135 .2042 3 ASN 3 .1528 -2.3357 999.9900 999.9900 .7518 -.4770 .6677 .3633 .4901 -.0800 4 ALA 4 -3.0686 999.9900 999.9900 999.9900 .7458 -1.1614 .6705 .3078 .4589 -.3361 5 GLU 5 -1.9096 -1.7714 999.9900 -1.0323 .6899 -1.0058 .6815 .5183 .5863 -.4706 6 PHE 6 -2.3628 -.4925 999.9900 999.9900 .7573 -.6993 .6761 .1128 .3475 -.2618 7 ASP 7 -.9091 -2.4630 999.9900 999.9900 .8104 -.8539 .4903 .3782 .4250 -.3386 8 PRO 8 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .5314 -.3564 .0135 -.1223 9 ASP 9 .4007 -2.4630 999.9900 999.9900 .8104 -.4173 .6731 .3813 .5029 -.0395 10 LEU 10 -.4416 -1.3608 999.9900 999.9900 .9565 -.2820 .4811 .1569 .2920 -.0416 11 PRO 11 .4197 999.9900 999.9900 999.9900 .4496 .4347 .5390 -.3653 .0115 .2608 12 GLY 12 -1.7079 999.9900 999.9900 999.9900 .7883 -.4598 .5855 .4777 .5256 .0359 13 GLY 13 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5705 .4694 .5143 -.0290 14 GLY 14 -1.9441 999.9900 999.9900 999.9900 .7883 -.5779 .5875 .4699 .5221 -.0246 15 LEU 15 -1.4213 -.6635 999.9900 999.9900 .9565 -.3761 .6786 .1521 .3714 -.0595 16 HIS 16 -2.1861 -3.1083 999.9900 999.9900 .6686 -1.5419 .6763 .3361 .4779 -.7227 17 ARG 17 -.0990 -2.8571 999.9900 .1593 .8581 -.3559 .6729 .5164 .5816 -.0843 18 CYS 18 .0411 999.9900 .1296 999.9900 .9108 .3605 .6783 .3114 .4643 .4142 19 LEU 19 .8442 -2.1315 999.9900 999.9900 .9565 -.1103 .6746 .1611 .3751 .1010 20 ALA 20 .0579 999.9900 999.9900 999.9900 .7458 .4018 .6662 .3036 .4547 .4434 21 CYS 21 -.8048 999.9900 .8629 999.9900 .9108 .3229 .6789 .3252 .4725 .3946 22 ALA 22 -2.6726 999.9900 999.9900 999.9900 .7458 -.9634 .6606 .3155 .4593 -.2377 23 ARG 23 -.7228 -1.7413 999.9900 .1593 .8581 -.2575 .6781 .5179 .5847 -.0130 24 TYR 24 -.9465 -1.6992 999.9900 999.9900 .5630 -.6942 .6784 -.1767 .1796 -.3162 25 PHE 25 -.8715 -1.1947 999.9900 999.9900 .7573 -.4363 .6786 .1131 .3487 -.1034 26 ILE 26 -1.3252 -1.3043 999.9900 999.9900 .6034 -.6754 .6539 .0368 .2939 -.2671 27 ASP 27 -.7312 -2.1980 999.9900 999.9900 .8104 -.7063 .6792 .3801 .5048 -.2119 28 SER 28 .2739 999.9900 -.7153 999.9900 .6705 .0763 .6762 .5333 .5929 .2877 29 THR 29 .8449 999.9900 -.8810 999.9900 .4476 .1372 .6603 -.2716 .1167 .1600 30 ASN 30 .9310 -.8278 999.9900 999.9900 .7518 .2850 .6826 .3867 .5100 .3849 31 LEU 31 .6296 -2.5464 999.9900 999.9900 .9565 -.3201 .6753 .1647 .3774 -.0241 32 LYS 32 1.0429 -1.8181 999.9900 .4411 .7460 .1706 .6790 .1636 .3783 .2422 33 THR 33 .7717 999.9900 -.8810 999.9900 .4476 .1128 .6638 -.2674 .1206 .1469 34 HIS 34 1.3920 -1.3248 999.9900 999.9900 .6686 .2453 .6806 .3209 .4707 .3475 35 PHE 35 -.5261 -.7088 999.9900 999.9900 .7573 -.1592 .6772 .0969 .3387 .0593 36 ARG 36 -.7545 -1.0274 999.9900 .1593 .8581 -.1210 .6834 .5215 .5889 .0857 37 SER 37 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6791 .5322 .5934 -.5187 38 LYS 38 .2805 -1.1755 999.9900 -.0397 .7460 -.0457 .6794 .1476 .3692 .0855 39 ASP 39 .8349 -2.6388 999.9900 999.9900 .8104 -.3311 .6678 .3748 .4968 .0098 40 HIS 40 .6603 1.1894 999.9900 999.9900 .6686 .8394 .6778 .3236 .4712 .7039 41 LYS 41 .7090 -.1814 999.9900 -.0397 .7460 .2388 .6653 .1572 .3689 .2881 42 LYS 42 .6751 -1.1257 999.9900 1.0898 .7460 .4950 .6795 .1642 .3789 .4741 43 ARG 43 .0418 -1.5080 999.9900 .6901 .8581 .1544 .6746 .5229 .5861 .2814 44 LEU 44 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .6801 .1524 .3723 -.1191 45 LYS 45 1.0429 -.4366 999.9900 -.4035 .7460 .1090 .6730 .1589 .3731 .1967 46 GLN 46 1.0381 -.4838 999.9900 1.3059 .5113 .5929 .6783 .5256 .5892 .5959 47 LEU 47 .8475 -2.7185 999.9900 999.9900 .9565 -.3048 .6744 .1688 .3794 -.0143 48 SER 48 -1.2908 999.9900 -.7153 999.9900 .6705 -.4452 .6729 .5366 .5934 -.0252 49 VAL 49 -1.4939 999.9900 .1416 999.9900 .7810 -.1904 .6647 .1295 .3525 .0446 50 GLU 50 -3.2255 -1.9198 999.9900 -1.0323 .6899 -1.3719 .4962 .5195 .5098 -.7453 51 PRO 51 -1.9661 999.9900 999.9900 999.9900 .4496 -.7582 .5342 -.3718 .0057 -.3385 52 TYR 52 -3.6999 -2.3638 999.9900 999.9900 .5630 -1.8336 .6806 -.1832 .1767 -1.0007 53 SER 53 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .6799 .5308 .5929 -.5188 54 GLN 54 -3.1236 -2.2325 999.9900 1.3059 .5113 -.8847 .6808 .5249 .5899 -.3889 55 GLU 55 -.4382 -2.3808 999.9900 -1.0323 .6899 -.7904 .6789 .5238 .5884 -.3265 56 GLU 56 -2.3953 -2.3808 999.9900 -1.0323 .6899 -1.2796 .6807 .5270 .5910 -.6518 57 ALA 57 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6621 .3154 .4599 -.4353 58 GLU 58 -.2127 -.6748 999.9900 -1.0323 .6899 -.3075 .6807 .5234 .5890 -.0043 59 ARG 59 -1.7561 -2.8571 999.9900 .1593 .8581 -.6873 .6707 .5236 .5849 -.3203 60 ALA 60 -3.4646 999.9900 999.9900 999.9900 .7458 -1.3594 .6626 .3252 .4658 -.4328 61 ALA 61 -.5171 999.9900 999.9900 999.9900 .7458 .1144 .6755 .3283 .4729 .3081 62 GLY 62 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5764 .4753 .5202 -.4116 63 MET 63 -2.6662 -1.4323 999.9900 .9587 .5203 -.6549 .6817 .5200 .5874 -.2363 64 GLY 64 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .5853 .4819 .5278 -.4077 65 SER 65 -.3328 999.9900 -.7153 999.9900 .6705 -.1259 .6799 .5354 .5956 .1675 66 TYR 66 -3.6999 -2.7782 999.9900 999.9900 .5630 -1.9717 .6792 -.1959 .1687 -1.0864 67 VAL 67 999.9900 999.9900 -1.0788 999.9900 999.9900 -1.0788 .6429 -.0987 .2192 -.1782 Means: -.9476 -1.7376 -.4803 .1128 .7264 -.4124 .6493 .2594 .4227 -.0755 2.00 analyzed_13