1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8897 .8897 .7068 .7063 .7066 .7676 2 SER 2 -2.3021 999.9900 -.7153 999.9900 .6705 -.7823 .7061 .7033 .7044 -.1875 3 ASP 3 -1.0941 -1.9171 999.9900 999.9900 .8104 -.7336 .7066 .6523 .6749 -.1684 4 PRO 4 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7068 .6135 .6524 .4051 5 GLY 5 -.9395 999.9900 999.9900 999.9900 .7883 -.0756 .7064 .6631 .6823 .3046 6 PRO 6 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7065 .6060 .6479 .4116 7 GLU 7 .8733 -.8493 999.9900 -1.0323 1.0761 .0169 .7058 .7033 .7044 .2461 8 ALA 8 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7068 .7053 .7059 .7019 9 ALA 9 .6648 999.9900 999.9900 999.9900 .7458 .7053 .7071 .7055 .7061 .7058 10 ARG 10 .6041 .2312 999.9900 .6901 .8581 .6147 .7058 .7025 .7038 .6403 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .8331 -.5172 .7062 .7031 .7044 -.0285 12 ARG 12 .8354 1.1699 999.9900 .6901 .8581 .8487 .7069 .7032 .7048 .8077 13 PHE 13 .7405 -1.1947 999.9900 999.9900 .8629 .1362 .7065 .7035 .7048 .3637 14 ARG 14 .1485 -.3726 999.9900 .1593 .8581 .1905 .7060 .7038 .7047 .3375 15 CYS 15 .1005 999.9900 .1296 999.9900 .4013 .2105 .7064 .7035 .7047 .4083 16 PHE 16 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7066 .7024 .7041 .1184 17 HIS 17 -.5497 -3.1083 999.9900 999.9900 .5967 -1.0205 .7059 .7029 .7041 -.3305 18 TYR 18 .1133 -.2298 999.9900 999.9900 .5630 .1488 .7066 .7031 .7046 .3712 19 GLU 19 -1.0162 -2.3808 999.9900 1.1588 .6899 -.3871 .7067 .7034 .7048 -.0230 20 GLU 20 .0468 -.0757 999.9900 .3501 .6899 .2528 .7060 .7029 .7042 .4033 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7069 .7051 .7059 .7084 22 THR 22 -.2915 999.9900 -.8810 999.9900 .4476 -.2416 .7062 .7066 .7064 .1376 23 GLY 23 -.7885 999.9900 999.9900 999.9900 .7883 -.0001 .7068 .6581 .6797 .3412 24 PRO 24 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7059 .6100 .6500 .3401 25 GLN 25 1.0064 .1064 999.9900 2.7911 .5113 1.1038 .7069 .7031 .7047 .9709 26 GLU 26 .8733 -1.5476 999.9900 -1.0323 1.0761 -.1576 .7061 .7031 .7043 .1298 27 ALA 27 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7051 .7056 .7054 .5753 28 LEU 28 .8182 -1.2483 999.9900 999.9900 .8331 .1344 .7066 .7027 .7043 .3625 29 ALA 29 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7070 .7049 .7058 .6844 30 GLN 30 .1338 -2.2325 999.9900 1.3059 .5113 -.0704 .7059 .7039 .7047 .1880 31 LEU 31 .6296 -.1732 999.9900 999.9900 .9565 .4710 .7065 .7022 .7040 .5643 32 ARG 32 .9556 -.1588 999.9900 .1593 .8581 .3947 .7056 .7022 .7036 .4830 33 GLU 33 1.0761 -1.5476 999.9900 .3501 .6899 .1421 .7049 .7034 .7040 .3295 34 LEU 34 .8442 .6031 999.9900 999.9900 .9565 .8013 .7062 .7023 .7040 .7625 35 CYS 35 1.4696 999.9900 .1296 999.9900 .4013 .6668 .7067 .7034 .7048 .6821 36 ARG 36 .6041 -2.8571 999.9900 .1593 .8581 -.2153 .7064 .7027 .7042 .0475 37 GLN 37 .3572 -2.2325 999.9900 1.3059 .5113 -.0145 .7062 .7039 .7048 .2253 38 TRP 38 -1.3140 -3.3859 999.9900 999.9900 .9378 -1.2540 .7051 .7035 .7042 -.4707 39 LEU 39 -.2410 -1.5832 999.9900 999.9900 .9565 -.2892 .7063 .7025 .7041 .1082 40 ARG 40 -1.9585 .2472 999.9900 .1593 .8581 -.1069 .7069 .6595 .6793 .1188 41 PRO 41 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7068 .6081 .6492 .3076 42 GLU 42 -.1289 -1.6501 999.9900 -1.0323 .6899 -.5304 .7067 .7035 .7048 -.1185 43 VAL 43 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7069 .7062 .7065 -.0390 44 ARG 44 -.5855 -.1044 999.9900 .1593 .6728 .0603 .7059 .7040 .7048 .2445 45 SER 45 -.7443 999.9900 -.7153 999.9900 .6705 -.2630 .7068 .7033 .7048 .1242 46 LYS 46 .7090 .7299 999.9900 .3240 .7460 .5666 .7065 .7021 .7040 .6059 47 GLU 47 .8733 -1.3104 999.9900 -1.0323 .3568 -.2782 .7065 .7034 .7047 .0495 48 GLN 48 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7069 .7033 .7048 .2900 49 MET 49 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7067 .7036 .7049 .1913 50 LEU 50 .2355 -2.0611 999.9900 999.9900 .9565 -.2897 .7064 .7030 .7044 .1081 51 GLU 51 .8733 -1.1358 999.9900 -1.0323 .6899 -.1513 .7059 .7030 .7043 .1340 52 LEU 52 .8786 -.2454 999.9900 999.9900 .9565 .5299 .7054 .7026 .7038 .5995 53 LEU 53 .6509 -2.0611 999.9900 999.9900 .8331 -.1924 .7062 .7023 .7039 .1663 54 VAL 54 .5660 999.9900 .5873 999.9900 .7810 .6448 .7050 .7053 .7052 .6689 55 LEU 55 .9913 -2.9612 999.9900 999.9900 .9565 -.3378 .7062 .7026 .7041 .0791 56 GLU 56 .0908 -2.1111 999.9900 .3501 .6899 -.2451 .7060 .7031 .7043 .0715 57 GLN 57 .6461 -1.7668 999.9900 1.3059 .5113 .1741 .7065 .7032 .7046 .3510 58 PHE 58 .7853 -.6308 999.9900 999.9900 .7573 .3040 .7063 .7034 .7046 .4643 59 LEU 59 .4996 -1.5540 999.9900 999.9900 .8331 -.0738 .7049 .7032 .7039 .2374 60 GLY 60 -.2363 999.9900 999.9900 999.9900 .7883 .2760 .7068 .7048 .7057 .4909 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7061 .7047 .7053 .4996 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7065 .6557 .6768 -.0293 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7064 .6400 .6677 .3749 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7062 .6076 .6486 .3073 65 GLU 65 -1.3222 -.7281 999.9900 -1.0323 .6899 -.5982 .7060 .7019 .7036 -.1641 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7067 .7064 .7065 .7159 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7068 .7040 .7052 .8110 68 ALA 68 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7070 .7059 .7064 .7637 69 ARG 69 .6323 -.7463 999.9900 1.0856 .8581 .5831 .7063 .7031 .7044 .6178 70 VAL 70 .7683 999.9900 -.5532 999.9900 .7810 .3321 .7069 .7059 .7063 .4818 71 GLN 71 .7451 -2.6982 999.9900 1.3059 .5113 -.0340 .7066 .7028 .7044 .2123 72 GLY 72 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7065 .7040 .7051 .4957 73 GLN 73 -2.0516 -1.7668 999.9900 1.3059 .5113 -.5003 .7067 .7038 .7050 -.0985 74 ARG 74 -2.5097 -.2494 999.9900 .1593 .8581 -.3165 .7066 .6610 .6800 -.0307 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7060 .6171 .6541 -.1359 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7068 .7052 .7059 .6253 77 SER 77 .0280 999.9900 -.7153 999.9900 .6705 -.0056 .7062 .6484 .6725 .2675 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7065 .6148 .6530 -.1364 79 GLU 79 .8733 -1.4588 999.9900 -1.0323 .6899 -.2320 .7058 .7033 .7043 .0802 80 GLU 80 .8733 -.3559 999.9900 -1.0323 1.0761 .1403 .7062 .7040 .7049 .3286 81 ALA 81 .6648 999.9900 999.9900 999.9900 .7458 .7053 .7071 .7054 .7061 .7057 82 ALA 82 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7049 .7057 .6843 83 ALA 83 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7059 .7051 .7054 .6733 84 LEU 84 .6296 -2.1315 999.9900 999.9900 .8331 -.2230 .7063 .7015 .7035 .1478 85 VAL 85 .7260 999.9900 -1.0788 999.9900 .7810 .1428 .7066 .7060 .7063 .3682 86 ASP 86 .3915 -.3302 999.9900 999.9900 .8104 .2906 .7054 .7036 .7043 .4561 87 GLY 87 -1.3427 999.9900 999.9900 999.9900 .8277 -.2575 .7065 .7059 .7061 .2243 88 LEU 88 .4996 -.2454 999.9900 999.9900 .9565 .4035 .7067 .7024 .7042 .5239 89 ARG 89 -2.9267 -.5982 999.9900 .1593 .6728 -.5067 .7065 .7037 .7049 -.1605 90 ARG 90 -.5733 1.0858 999.9900 .1593 .8581 .3379 .7062 .7026 .7041 .4426 91 GLU 91 -2.8104 .0644 999.9900 -1.0323 .6899 -.7721 .7068 .6504 .6739 -.2885 92 PRO 92 -2.2417 999.9900 999.9900 999.9900 .4496 -.8960 .7061 .6110 .6506 -.1187 93 GLY 93 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .7065 .7057 .7060 -.3215 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7065 .5562 .6421 .6314 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8897 .8897 .7067 .7059 .7062 .7674 96 SER 302 -2.3021 999.9900 -.7153 999.9900 .6705 -.7823 .7069 .7025 .7043 -.1875 97 ASP 303 -1.0941 -1.9171 999.9900 999.9900 .8104 -.7336 .7066 .6559 .6770 -.1677 98 PRO 304 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7060 .6141 .6524 .4050 99 GLY 305 -.9395 999.9900 999.9900 999.9900 .7883 -.0756 .7069 .6579 .6797 .3034 100 PRO 306 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7056 .6199 .6556 .4149 101 GLU 307 .8733 -.8493 999.9900 .3501 .6899 .2660 .7060 .7035 .7045 .4122 102 ALA 308 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7070 .7059 .7063 .7021 103 ALA 309 .6648 999.9900 999.9900 999.9900 .8416 .7532 .7068 .7056 .7061 .7297 104 ARG 310 .6041 .2312 999.9900 .6901 .8581 .6147 .7050 .7027 .7037 .6402 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7061 .7026 .7041 -.0039 106 ARG 312 .8354 1.1781 999.9900 .6901 .8581 .8504 .7068 .7026 .7043 .8087 107 PHE 313 .7405 -2.0028 999.9900 999.9900 .7573 -.1683 .7062 .7031 .7044 .1809 108 ARG 314 .1485 -.3726 999.9900 .1593 .8581 .1905 .7068 .7032 .7047 .3375 109 CYS 315 .1005 999.9900 .1296 999.9900 .4013 .2105 .7058 .7041 .7048 .4083 110 PHE 316 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7065 .7036 .7048 .1186 111 HIS 317 -.5497 -3.1083 999.9900 999.9900 .5967 -1.0205 .7061 .7034 .7045 -.3304 112 TYR 318 .1133 -.2298 999.9900 999.9900 .5630 .1488 .7054 .7026 .7038 .3709 113 GLU 319 -1.0162 -2.3808 999.9900 -1.0323 .3568 -1.0182 .7067 .7034 .7048 -.4437 114 GLU 320 .0468 -.0757 999.9900 -1.0323 .6899 -.0928 .7057 .7031 .7042 .1729 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7058 .7040 .7047 .6839 116 THR 322 -.2915 999.9900 -.8810 999.9900 .4476 -.2416 .7057 .7065 .7062 .1375 117 GLY 323 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7063 .6540 .6773 .4338 118 PRO 324 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7066 .6157 .6536 .3417 119 GLN 325 1.0064 .1064 999.9900 1.3059 .5113 .7325 .7064 .7037 .7048 .7234 120 GLU 326 .1885 -1.5476 999.9900 -1.0323 .6899 -.4254 .7064 .7022 .7039 -.0488 121 ALA 327 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7062 .7046 .7052 .5753 122 LEU 328 .8182 -1.2483 999.9900 999.9900 .8331 .1344 .7065 .7023 .7041 .3624 123 ALA 329 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7044 .7054 .6842 124 GLN 330 .1030 -2.6982 999.9900 1.3059 .5113 -.1945 .7063 .7045 .7053 .1055 125 LEU 331 .9913 -.1732 999.9900 999.9900 .9565 .5915 .7062 .7017 .7036 .6365 126 ARG 332 .9556 -.0184 999.9900 .1593 .8581 .4228 .7066 .7021 .7039 .5032 127 GLU 333 1.0761 -1.5476 999.9900 .3501 .6899 .1421 .7067 .7024 .7042 .3296 128 LEU 334 .6296 .6031 999.9900 999.9900 .9565 .7297 .7066 .7032 .7046 .7198 129 CYS 335 1.1812 999.9900 .1296 999.9900 .4013 .5707 .7062 .7029 .7043 .6243 130 ARG 336 .6041 -2.8571 999.9900 .1593 .6728 -.2523 .7063 .7033 .7046 .0211 131 GLN 337 .3572 -2.2325 999.9900 1.3059 .5113 -.0145 .7060 .7035 .7045 .2252 132 TRP 338 -1.3140 -3.3859 999.9900 999.9900 .9378 -1.2540 .7062 .7035 .7046 -.4705 133 LEU 339 .0401 -1.6139 999.9900 999.9900 .9565 -.2058 .7064 .7028 .7043 .1584 134 ARG 340 -1.7561 .2472 999.9900 .1593 .8581 -.0664 .7061 .6541 .6758 .1469 135 PRO 341 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7054 .6114 .6506 .3081 136 GLU 342 -.1289 -1.6501 999.9900 -1.0323 .6899 -.5304 .7062 .7023 .7039 -.1188 137 VAL 343 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7068 .7062 .7064 -.0390 138 ARG 344 -.4840 -.4762 999.9900 .6901 .6728 .2185 .7068 .7033 .7048 .3575 139 SER 345 -.7443 999.9900 -.7153 999.9900 .6705 -.2630 .7070 .7021 .7041 .1240 140 LYS 346 1.0429 .1030 999.9900 .3240 .7460 .5080 .7068 .7029 .7045 .5642 141 GLU 347 .8604 -1.6501 999.9900 -1.0323 .6899 -.2830 .7066 .7024 .7041 .0461 142 GLN 348 .9732 -2.2325 999.9900 1.3059 .5113 .1395 .7071 .7030 .7047 .3280 143 MET 349 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7065 .7040 .7050 .1913 144 LEU 350 .8182 -.8597 999.9900 999.9900 .9565 .3050 .7066 .7020 .7039 .4647 145 GLU 351 .8733 -1.1358 999.9900 -1.0323 .6899 -.1513 .7045 .7037 .7040 .1339 146 LEU 352 .4996 -.2454 999.9900 999.9900 .8331 .3624 .7062 .7029 .7043 .4993 147 LEU 353 -.0169 -2.0611 999.9900 999.9900 .8331 -.4149 .7064 .7031 .7045 .0329 148 VAL 354 .5660 999.9900 .8662 999.9900 .7810 .7377 .7064 .7059 .7061 .7251 149 LEU 355 .9913 -2.9612 999.9900 999.9900 .9565 -.3378 .7057 .7028 .7040 .0790 150 GLU 356 .0908 -2.1111 999.9900 .3501 .6899 -.2451 .7067 .7032 .7046 .0716 151 GLN 357 .6461 -1.7668 999.9900 1.3059 .5113 .1741 .7067 .7033 .7047 .3511 152 PHE 358 .7853 -.1636 999.9900 999.9900 .7573 .4597 .7064 .7033 .7046 .5578 153 LEU 359 .4996 -1.3405 999.9900 999.9900 .8331 -.0026 .7061 .7015 .7034 .2799 154 GLY 360 -.2363 999.9900 999.9900 999.9900 .7883 .2760 .7063 .7059 .7061 .4910 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7052 .7056 .7055 .4996 156 LEU 362 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7066 .6513 .6744 -.0302 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7067 .6404 .6680 .3750 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7067 .6119 .6514 .3085 159 GLU 365 -1.3222 -.7281 999.9900 -1.0323 .6899 -.5982 .7055 .7021 .7035 -.1642 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7068 .7059 .7063 .7158 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7067 .7033 .7047 .8108 162 ALA 368 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7068 .7050 .7057 .7634 163 ARG 369 .6323 -.7463 999.9900 .1593 .8581 .2126 .7066 .7031 .7045 .3532 164 VAL 370 .7683 999.9900 .1416 999.9900 .7810 .5637 .7063 .7055 .7059 .6206 165 GLN 371 .7451 -2.6982 999.9900 1.3059 .5113 -.0340 .7067 .7037 .7049 .2124 166 GLY 372 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7065 .7045 .7054 .4959 167 GLN 373 -2.2003 -1.7668 999.9900 1.3059 .5113 -.5375 .7066 .7032 .7046 -.1233 168 ARG 374 -2.5097 -.2494 999.9900 .1593 .8581 -.3165 .7063 .6603 .6795 -.0308 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7053 .6181 .6544 -.1359 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7065 .7051 .7057 .6252 171 SER 377 .0280 999.9900 -.7153 999.9900 .6705 -.0056 .7066 .6483 .6726 .2676 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7059 .6103 .6501 -.1377 173 GLU 379 .8733 -1.4588 999.9900 -1.0323 .6899 -.2320 .7067 .7031 .7046 .0803 174 GLU 380 .8733 -.6022 999.9900 -1.0323 1.0761 .0787 .7066 .7031 .7045 .2874 175 ALA 381 .6648 999.9900 999.9900 999.9900 .7458 .7053 .7069 .7053 .7060 .7057 176 ALA 382 .5799 999.9900 999.9900 999.9900 .7881 .6840 .7062 .7058 .7059 .6950 177 ALA 383 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7058 .7056 .7057 .6734 178 LEU 384 .6296 -2.1315 999.9900 999.9900 .8331 -.2230 .7054 .7012 .7030 .1475 179 VAL 385 .7260 999.9900 -1.0788 999.9900 .7810 .1428 .7066 .7065 .7065 .3683 180 ASP 386 .3915 -.4801 999.9900 999.9900 .8104 .2406 .7055 .7034 .7043 .4261 181 GLY 387 -1.3427 999.9900 999.9900 999.9900 .8277 -.2575 .7064 .7057 .7060 .2243 182 LEU 388 .4996 -.2454 999.9900 999.9900 .9565 .4035 .7069 .7027 .7044 .5240 183 ARG 389 -2.9267 -.5982 999.9900 .5548 .8581 -.3114 .7068 .7037 .7050 -.0210 184 ARG 390 -.5733 1.0858 999.9900 .1593 .8581 .3379 .7057 .7022 .7037 .4425 185 GLU 391 -2.8104 .0644 999.9900 -1.0323 .6899 -.7721 .7065 .6512 .6742 -.2885 186 PRO 392 -2.2417 999.9900 999.9900 999.9900 .4496 -.8960 .7052 .6276 .6600 -.1148 187 GLY 393 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .7057 .7046 .7051 -.3219 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7057 .7052 .7055 .7055 Means: -.0995 -1.0485 -.3353 .2630 .7190 .0261 .7063 .6907 .6973 .2867 2.00 analyzed_15