1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7068 .7059 .7064 .7468 2 SER 2 -1.0548 999.9900 -.7153 999.9900 .6705 -.3665 .7066 .7024 .7041 .0619 3 ASP 3 -2.5838 -1.5469 999.9900 999.9900 .8104 -1.1068 .7065 .6529 .6753 -.3922 4 PRO 4 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7061 .6140 .6524 .3089 5 GLY 5 -1.1609 999.9900 999.9900 999.9900 .8277 -.1666 .7070 .6590 .6803 .2582 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7068 .6026 .6460 .3385 7 GLU 7 .8733 -2.3808 999.9900 -1.0323 1.0761 -.3659 .7060 .7029 .7042 -.0091 8 ALA 8 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7069 .7060 .7064 .7021 9 ALA 9 .7636 999.9900 999.9900 999.9900 .7458 .7547 .7070 .7050 .7059 .7304 10 ARG 10 .6041 .0684 999.9900 .1593 .8581 .3699 .7068 .7023 .7042 .4655 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .8331 -.5172 .7063 .7026 .7041 -.0285 12 ARG 12 .6655 .7317 999.9900 .1593 .8581 .5148 .7068 .7028 .7045 .5691 13 PHE 13 .6090 -1.1947 999.9900 999.9900 .8629 .0924 .7062 .7028 .7042 .3372 14 ARG 14 -.4439 -1.4154 999.9900 .6901 .8581 .0758 .7062 .7035 .7047 .2555 15 CYS 15 .3033 999.9900 .1296 999.9900 .4013 .2781 .7067 .7038 .7050 .4490 16 PHE 16 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7064 .7025 .7041 .1184 17 HIS 17 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7060 .7037 .7046 -.1527 18 TYR 18 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7058 .7038 .7046 .3044 19 GLU 19 -1.0962 -1.4588 999.9900 1.1588 .6899 -.1766 .7058 .7036 .7045 .1172 20 GLU 20 .0468 -2.3808 999.9900 .3501 .6899 -.3235 .7062 .7035 .7046 .0193 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7069 .7052 .7059 .7084 22 THR 22 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7058 .7063 .7061 .1510 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7068 .6598 .6807 .1565 24 PRO 24 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7062 .6029 .6459 .1612 25 GLN 25 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7060 .7034 .7045 .2558 26 GLU 26 .8733 -1.5476 999.9900 1.7325 .6899 .4370 .7058 .7033 .7043 .5262 27 ALA 27 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7045 .7042 .7043 .7446 28 LEU 28 .8182 .1975 999.9900 999.9900 .8331 .6163 .7062 .7031 .7044 .6516 29 ALA 29 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7065 .7047 .7055 .7453 30 GLN 30 .9013 -2.6982 999.9900 1.3059 .5113 .0051 .7062 .7031 .7044 .2383 31 LEU 31 .8182 -.1732 999.9900 999.9900 .9565 .5339 .7069 .7035 .7049 .6024 32 ARG 32 .9556 .4266 999.9900 .7862 .8581 .7625 .7058 .7021 .7036 .7458 33 GLU 33 1.0761 -.1765 999.9900 -1.0323 .6899 .1393 .7060 .7021 .7037 .3275 34 LEU 34 .8442 .8710 999.9900 999.9900 .9565 .8906 .7053 .7023 .7035 .8159 35 CYS 35 1.3086 999.9900 .1296 999.9900 .4013 .6132 .7067 .7033 .7047 .6499 36 ARG 36 .6041 -2.8571 999.9900 .6901 .8581 -.0030 .7061 .7022 .7038 .1991 37 GLN 37 -.1264 -1.9601 999.9900 1.3059 .5113 -.0673 .7050 .7042 .7045 .1900 38 TRP 38 -1.3140 -3.3859 999.9900 999.9900 .9378 -1.2540 .7042 .7026 .7033 -.4710 39 LEU 39 -.8032 -1.7966 999.9900 999.9900 .9565 -.5478 .7063 .7025 .7041 -.0469 40 ARG 40 -2.9267 -.1176 999.9900 .1593 .8581 -.3735 .7064 .6518 .6745 -.0728 41 PRO 41 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7061 .6143 .6526 .4136 42 GLU 42 -.3012 -.5578 999.9900 .3501 .6899 .0452 .7066 .7027 .7044 .2651 43 VAL 43 -2.3613 999.9900 .8055 999.9900 .7810 -.2583 .7069 .7067 .7068 .1278 44 ARG 44 -1.4318 -.3536 999.9900 .6901 .6728 .0535 .7063 .7033 .7046 .2396 45 SER 45 -1.2908 999.9900 .3727 999.9900 .7781 -.0467 .7067 .7035 .7048 .2540 46 LYS 46 .9480 .5211 999.9900 .1731 .7460 .5123 .7060 .7035 .7045 .5672 47 GLU 47 .8733 -1.0407 999.9900 -1.0323 .6899 -.1275 .7066 .7032 .7046 .1500 48 GLN 48 .7451 -1.7668 999.9900 1.3059 .5113 .1989 .7067 .7045 .7054 .3678 49 MET 49 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7059 .7032 .7043 .1911 50 LEU 50 .2355 -1.4996 999.9900 999.9900 .8331 -.1436 .7048 .7031 .7038 .1954 51 GLU 51 .1185 -1.1891 999.9900 .3501 .6899 -.0077 .7061 .7028 .7042 .2297 52 LEU 52 .8786 -1.6805 999.9900 999.9900 .8331 .0104 .7064 .7024 .7041 .2880 53 LEU 53 .6509 -1.6462 999.9900 999.9900 .8331 -.0541 .7064 .7028 .7043 .2494 54 VAL 54 1.0462 999.9900 .9224 999.9900 .7810 .9165 .7057 .7061 .7059 .8323 55 LEU 55 1.1349 .4002 999.9900 999.9900 .8331 .7894 .7066 .7030 .7045 .7556 56 GLU 56 .7157 -1.1358 999.9900 -1.0323 .6899 -.1906 .7062 .7027 .7042 .1077 57 GLN 57 .6461 -2.2325 999.9900 1.3059 .5113 .0577 .7069 .7035 .7049 .2735 58 PHE 58 .7853 .6387 999.9900 999.9900 .7573 .7271 .7064 .7019 .7038 .7179 59 LEU 59 .4996 -1.3405 999.9900 999.9900 .9565 .0385 .7042 .7022 .7030 .3044 60 GLY 60 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7063 .7048 .7054 .4465 61 ALA 61 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7067 .7052 .7058 .6735 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .9565 -.4618 .7066 .6605 .6797 -.0037 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7069 .6397 .6677 .3749 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7066 .6072 .6486 .3073 65 GLU 65 -2.0601 -.7281 999.9900 -1.0323 .6899 -.7826 .7068 .7041 .7053 -.2866 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7068 .7059 .7063 .7158 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7064 .7034 .7046 .8195 68 ALA 68 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7068 .7055 .7060 .7395 69 ARG 69 .6323 -.4990 999.9900 .1593 .8581 .2620 .7069 .7029 .7045 .3886 70 VAL 70 .8065 999.9900 .4980 999.9900 .7810 .6952 .7067 .7061 .7064 .6997 71 GLN 71 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7063 .7042 .7051 .2901 72 GLY 72 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7060 .7050 .7055 .4959 73 GLN 73 -2.2003 -.9251 999.9900 1.3059 .7898 -.2574 .7069 .7038 .7051 .0635 74 ARG 74 -2.5097 -.2494 999.9900 .6901 .8581 -.1042 .7063 .6548 .6763 .1200 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7044 .6151 .6523 -.1368 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8277 .5136 .7064 .7058 .7060 .6099 77 SER 77 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7067 .6485 .6727 .1775 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7066 .6091 .6497 -.1378 79 GLU 79 1.0761 .0026 999.9900 .3501 .6899 .5297 .7056 .7034 .7043 .5880 80 GLU 80 .1885 -.6022 999.9900 .3501 1.0761 .2531 .7064 .7035 .7047 .4037 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7881 .4230 .7067 .7050 .7057 .5644 82 ALA 82 .2107 999.9900 999.9900 999.9900 .7881 .4994 .7067 .7049 .7056 .6026 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7059 .7059 .7059 .4307 84 LEU 84 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7062 .7025 .7040 .0198 85 VAL 85 .5660 999.9900 .1416 999.9900 .8960 .5345 .7061 .7064 .7062 .6032 86 ASP 86 1.3227 -1.7105 999.9900 999.9900 .8104 .1409 .7059 .7033 .7044 .3664 87 GLY 87 -.5849 999.9900 999.9900 999.9900 .8277 .1214 .7066 .7051 .7058 .4136 88 LEU 88 .0401 .0414 999.9900 999.9900 .9565 .3460 .7064 .7031 .7045 .4895 89 ARG 89 -.1156 -1.1946 999.9900 .6901 .6728 .1485 .7066 .7035 .7048 .3075 90 ARG 90 1.1353 -2.8571 999.9900 .1593 .8581 -.1090 .7056 .7035 .7044 .1234 91 GLU 91 -3.2255 -1.0866 999.9900 1.1588 .6899 -.6159 .7065 .6516 .6745 -.1842 92 PRO 92 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7065 .6230 .6578 -.3210 93 GLY 93 -.6308 999.9900 999.9900 999.9900 .8277 .0984 .7064 .7050 .7056 .4021 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7061 .5478 .6383 .6270 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7070 .7063 .7066 .7470 96 SER 302 -1.0548 999.9900 -.7153 999.9900 .6705 -.3665 .7056 .7038 .7046 .0620 97 ASP 303 -2.5838 -1.5469 999.9900 999.9900 .8104 -1.1068 .7067 .6565 .6774 -.3914 98 PRO 304 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7051 .6198 .6554 .3101 99 GLY 305 -1.1609 999.9900 999.9900 999.9900 .8277 -.1666 .7070 .6554 .6784 .2573 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7066 .6107 .6507 .3404 101 GLU 307 .8733 -2.3808 999.9900 -1.0323 .6899 -.4625 .7063 .7038 .7048 -.0733 102 ALA 308 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7067 .7058 .7062 .7020 103 ALA 309 .7636 999.9900 999.9900 999.9900 .8416 .8026 .7069 .7053 .7060 .7544 104 ARG 310 .6041 .0684 999.9900 .1593 .8581 .3699 .7061 .7033 .7044 .4655 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7061 .7033 .7045 -.0038 106 ARG 312 .6655 .7317 999.9900 .1593 .8581 .5148 .7066 .7035 .7048 .5691 107 PHE 313 .6090 -2.0028 999.9900 999.9900 .8629 -.1770 .7066 .7038 .7050 .1759 108 ARG 314 -.4439 -1.4154 999.9900 .6901 .8581 .0758 .7056 .7029 .7040 .2553 109 CYS 315 .2727 999.9900 .1296 999.9900 .4013 .2679 .7066 .7041 .7051 .4429 110 PHE 316 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7061 .7039 .7048 .1186 111 HIS 317 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7045 .7038 .7041 -.1530 112 TYR 318 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7063 .7031 .7044 .3043 113 GLU 319 -1.0962 -1.6501 999.9900 -1.0323 .3568 -.8555 .7053 .7019 .7033 -.3358 114 GLU 320 .0468 -2.3808 999.9900 -1.0323 .6899 -.6691 .7061 .7029 .7042 -.2112 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7065 .7049 .7056 .6843 116 THR 322 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7057 .7053 .7055 .1508 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7069 .6522 .6765 .1546 118 PRO 324 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7058 .6135 .6519 .1638 119 GLN 325 1.0064 -2.6982 999.9900 1.3059 .7898 .1010 .7063 .7036 .7047 .3023 120 GLU 326 .8733 -1.5476 999.9900 -1.0323 .6899 -.2542 .7067 .7034 .7048 .0656 121 ALA 327 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7051 .7054 .7053 .7451 122 LEU 328 .8182 .1975 999.9900 999.9900 .8331 .6163 .7064 .7028 .7043 .6516 123 ALA 329 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7069 .7047 .7056 .7454 124 GLN 330 .9013 -1.9601 999.9900 1.3059 .5113 .1896 .7067 .7035 .7048 .3614 125 LEU 331 .8182 -.1732 999.9900 999.9900 .9565 .5339 .7063 .7021 .7039 .6020 126 ARG 332 .9556 .4266 999.9900 .6901 .8581 .7241 .7067 .7036 .7049 .7187 127 GLU 333 1.0761 -.1765 999.9900 1.7325 .6899 .8305 .7067 .7033 .7047 .7887 128 LEU 334 .8442 .8710 999.9900 999.9900 .9565 .8906 .7054 .7025 .7037 .8159 129 CYS 335 1.3086 999.9900 .1296 999.9900 .4013 .6132 .7068 .7042 .7053 .6501 130 ARG 336 .6041 -2.8571 999.9900 .1593 .8581 -.2153 .7056 .7029 .7040 .0475 131 GLN 337 -.0365 -1.4944 999.9900 1.3059 .5113 .0716 .7042 .7039 .7040 .2824 132 TRP 338 -.4530 -3.3859 999.9900 999.9900 .9378 -.9670 .7051 .7034 .7041 -.2985 133 LEU 339 .0401 -1.7966 999.9900 999.9900 .9565 -.2667 .7061 .7033 .7044 .1219 134 ARG 340 -2.9267 -.1176 999.9900 .1593 .8581 -.3735 .7062 .6545 .6761 -.0724 135 PRO 341 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7061 .6168 .6540 .4057 136 GLU 342 -.1289 -.5578 999.9900 -1.0323 .6899 -.2573 .7057 .7034 .7043 .0633 137 VAL 343 -2.3613 999.9900 -1.0788 999.9900 .7810 -.8863 .7066 .7061 .7063 -.2493 138 ARG 344 -.8233 -.1044 999.9900 .1593 .6728 .0127 .7070 .7033 .7048 .2106 139 SER 345 -.5560 999.9900 .3727 999.9900 .6705 .1624 .7064 .7024 .7041 .3792 140 LYS 346 -.1232 -2.9005 999.9900 -.4035 .7460 -.6169 .7060 .7029 .7042 -.2394 141 GLU 347 1.0761 -1.0407 999.9900 -1.0323 .3568 -.1600 .7063 .7031 .7045 .1282 142 GLN 348 1.2265 -1.7668 999.9900 1.3059 .5113 .3192 .7068 .7038 .7050 .4479 143 MET 349 .8846 -2.5481 999.9900 .9587 .5203 -.0461 .7063 .7040 .7049 .2043 144 LEU 350 .2355 -2.0611 999.9900 999.9900 .8331 -.3308 .7065 .7030 .7044 .0834 145 GLU 351 .1185 -1.1891 999.9900 -1.0323 .6899 -.3533 .7061 .7031 .7043 -.0006 146 LEU 352 .8786 -1.6805 999.9900 999.9900 .8331 .0104 .7052 .7023 .7035 .2877 147 LEU 353 .6509 -2.0611 999.9900 999.9900 .8331 -.1924 .7067 .7026 .7043 .1664 148 VAL 354 1.0462 999.9900 .8662 999.9900 .7810 .8978 .7064 .7061 .7062 .8212 149 LEU 355 1.1349 .4002 999.9900 999.9900 .9565 .8305 .7064 .7029 .7044 .7802 150 GLU 356 .7157 -1.1358 999.9900 -1.0323 .6899 -.1906 .7068 .7038 .7050 .1080 151 GLN 357 .6461 -2.6982 999.9900 1.3059 .5113 -.0587 .7065 .7033 .7046 .1958 152 PHE 358 .7853 .6387 999.9900 999.9900 .7573 .7271 .7062 .7028 .7042 .7181 153 LEU 359 .4996 -1.3405 999.9900 999.9900 .8331 -.0026 .7066 .7019 .7039 .2801 154 GLY 360 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7069 .7053 .7060 .4467 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7066 .7055 .7059 .4999 156 LEU 362 -2.6981 .6031 999.9900 999.9900 .8331 -.4206 .7059 .6551 .6763 .0198 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7069 .6405 .6681 .3751 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7061 .6076 .6487 .3073 159 GLU 365 -1.3222 -.7281 999.9900 .3501 .6899 -.2526 .7059 .7029 .7042 .0664 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7070 .7064 .7066 .7160 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7069 .7038 .7051 .8197 162 ALA 368 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7068 .7048 .7056 .7394 163 ARG 369 .6323 -.4990 999.9900 .1593 .8581 .2620 .7065 .7039 .7050 .3886 164 VAL 370 .8065 999.9900 -.0276 999.9900 .7810 .5200 .7064 .7060 .7061 .5945 165 GLN 371 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7068 .7023 .7042 .2898 166 GLY 372 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7069 .7039 .7052 .4958 167 GLN 373 -2.2003 -.9251 999.9900 1.3059 .5113 -.3270 .7069 .7036 .7049 .0170 168 ARG 374 -2.5097 -.2494 999.9900 .6901 .8581 -.1042 .7065 .6568 .6775 .1203 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7065 .6212 .6567 -.1348 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8277 .5136 .7069 .7042 .7054 .6096 171 SER 377 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7069 .6535 .6758 .1785 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7067 .6107 .6507 -.1374 173 GLU 379 1.0761 .0026 999.9900 .3501 .3568 .4464 .7062 .7038 .7048 .5326 174 GLU 380 .1885 -.6022 999.9900 .3501 .6899 .1566 .7052 .7027 .7038 .3390 175 ALA 381 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7069 .7057 .7062 .5541 176 ALA 382 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7070 .7052 .7060 .5922 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7064 .7050 .7056 .4306 178 LEU 384 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7061 .7023 .7039 .0197 179 VAL 385 .5660 999.9900 .1416 999.9900 .7810 .4962 .7066 .7061 .7063 .5803 180 ASP 386 1.3227 -1.7105 999.9900 999.9900 .8104 .1409 .7059 .7040 .7048 .3665 181 GLY 387 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .7065 .7059 .7061 .4039 182 LEU 388 .0401 .0414 999.9900 999.9900 .9565 .3460 .7060 .7021 .7037 .4892 183 ARG 389 -.1156 -1.1946 999.9900 .6901 .8581 .1856 .7070 .7035 .7049 .3341 184 ARG 390 1.1353 -2.8571 999.9900 .1593 .6728 -.1461 .7057 .7034 .7043 .0969 185 GLU 391 -3.2255 -1.0866 999.9900 1.1588 .6899 -.6159 .7060 .6583 .6782 -.1832 186 PRO 392 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7069 .6170 .6545 -.3224 187 GLY 393 -.6308 999.9900 999.9900 999.9900 .7883 .0787 .7063 .7054 .7058 .3923 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7064 .7059 .7061 .7061 Means: -.0810 -1.1145 -.0545 .3966 .7153 .0483 .7063 .6907 .6972 .3003 2.00 analyzed_8