1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7068 .7061 .7065 .7469 2 SER 2 -.3025 999.9900 .3727 999.9900 .6705 .2469 .7065 .7031 .7045 .4301 3 ASP 3 -.8891 -2.3194 999.9900 999.9900 .8104 -.7994 .7060 .6509 .6739 -.2082 4 PRO 4 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7058 .6190 .6552 .4062 5 GLY 5 -.4135 999.9900 999.9900 999.9900 .8277 .2071 .7062 .6537 .6770 .4435 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7064 .6086 .6493 .3398 7 GLU 7 .6116 -.8169 999.9900 -1.0323 .6899 -.1369 .7058 .7028 .7041 .1435 8 ALA 8 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7070 .7047 .7056 .7018 9 ALA 9 .7636 999.9900 999.9900 999.9900 .8416 .8026 .7070 .7058 .7063 .7545 10 ARG 10 .6041 .5490 999.9900 .6901 .8581 .6783 .7060 .7037 .7047 .6859 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7062 .7030 .7043 -.0038 12 ARG 12 .6323 1.0858 999.9900 .1593 .8581 .5790 .7070 .7034 .7049 .6151 13 PHE 13 1.0502 -2.0028 999.9900 999.9900 .7573 -.0651 .7065 .7037 .7049 .2430 14 ARG 14 .1485 -.9348 999.9900 .1593 .6728 .0410 .7067 .7031 .7046 .2307 15 CYS 15 -.2798 999.9900 .1296 999.9900 .4013 .0837 .7066 .7041 .7051 .3324 16 PHE 16 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7060 .7038 .7047 .1186 17 HIS 17 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7057 .7037 .7046 -.1528 18 TYR 18 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7069 .7024 .7043 .3043 19 GLU 19 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7056 .7035 .7044 -.2480 20 GLU 20 .0468 .1870 999.9900 2.1776 1.0761 .8719 .7067 .7031 .7046 .8162 21 ALA 21 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7061 .7054 .7057 .6843 22 THR 22 -.2485 999.9900 -.8810 999.9900 .4476 -.2273 .7061 .7054 .7057 .1459 23 GLY 23 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .7063 .6577 .6793 -.1298 24 PRO 24 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7064 .6103 .6503 .3403 25 GLN 25 .8469 .1064 999.9900 1.3059 .5113 .6926 .7066 .7029 .7045 .6967 26 GLU 26 .8733 -1.5476 999.9900 1.1588 .6899 .2936 .7064 .7034 .7047 .4307 27 ALA 27 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7068 .7058 .7062 .5757 28 LEU 28 .8182 .5655 999.9900 999.9900 .8331 .7389 .7063 .7029 .7043 .7252 29 ALA 29 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7045 .7055 .6843 30 GLN 30 .1030 -2.2325 999.9900 1.3059 .5113 -.0781 .7064 .7037 .7048 .1830 31 LEU 31 .6509 -.2454 999.9900 999.9900 .9565 .4540 .7055 .7025 .7037 .5540 32 ARG 32 1.0056 .8164 999.9900 .5548 .8581 .7579 .7060 .7035 .7046 .7428 33 GLU 33 .6833 -2.8418 999.9900 -1.0323 .6899 -.6253 .7064 .7030 .7044 -.1819 34 LEU 34 -.1421 -.0413 999.9900 999.9900 .9565 .2577 .7057 .7029 .7040 .4363 35 CYS 35 .6740 999.9900 .1296 999.9900 .4013 .4016 .7068 .7044 .7054 .5232 36 ARG 36 .8469 -2.8571 999.9900 .6901 .8581 .0456 .7064 .7032 .7045 .2339 37 GLN 37 .0311 -2.6982 999.9900 1.3059 .5113 -.2125 .7048 .7030 .7038 .0930 38 TRP 38 -1.4299 -3.3859 999.9900 999.9900 .9378 -1.2927 .7056 .7042 .7048 -.4936 39 LEU 39 .0401 -2.9612 999.9900 999.9900 .9565 -.6549 .7055 .7032 .7042 -.1112 40 ARG 40 -2.9267 -1.5080 999.9900 .1593 .8581 -.6516 .7067 .6582 .6784 -.2704 41 PRO 41 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7063 .6174 .6544 .3098 42 GLU 42 -.1289 -1.1891 999.9900 -1.0323 .6899 -.4151 .7067 .7034 .7047 -.0417 43 VAL 43 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7065 .7065 .7065 -.0390 44 ARG 44 -.4945 -.4762 999.9900 .1593 .6728 .0041 .7063 .7037 .7048 .2044 45 SER 45 -.4961 999.9900 -.7153 999.9900 .6705 -.1803 .7066 .7030 .7045 .1737 46 LYS 46 1.0429 -.3112 999.9900 .4411 .7460 .4720 .7066 .7028 .7044 .5385 47 GLU 47 .8604 -.3402 999.9900 -1.0323 .6899 .0444 .7064 .7021 .7039 .2644 48 GLN 48 1.0381 -1.7668 999.9900 1.3059 .5113 .2721 .7066 .7024 .7042 .4163 49 MET 49 .8434 -2.5481 999.9900 .9587 .5203 -.0564 .7065 .7037 .7048 .1974 50 LEU 50 .2355 -2.5464 999.9900 999.9900 .9565 -.4514 .7065 .7036 .7048 .0112 51 GLU 51 .5470 -1.1891 999.9900 2.1776 .6899 .5563 .7060 .7034 .7045 .6058 52 LEU 52 .8786 -.2454 999.9900 999.9900 .8331 .4887 .7052 .7028 .7038 .5749 53 LEU 53 .6509 -1.7554 999.9900 999.9900 .8331 -.0905 .7048 .7027 .7036 .2272 54 VAL 54 .1911 999.9900 .9747 999.9900 .7810 .6489 .7064 .7056 .7059 .6717 55 LEU 55 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7068 .7026 .7044 .0545 56 GLU 56 .0908 -2.1111 999.9900 .3501 .6899 -.2451 .7057 .7035 .7044 .0715 57 GLN 57 .6461 -1.7668 999.9900 1.3059 .7898 .2437 .7061 .7039 .7048 .3975 58 PHE 58 .7853 .6387 999.9900 999.9900 .7573 .7271 .7056 .7027 .7039 .7179 59 LEU 59 .4996 -1.3405 999.9900 999.9900 .8331 -.0026 .7056 .7025 .7038 .2801 60 GLY 60 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7064 .7050 .7056 .6123 61 ALA 61 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7068 .7058 .7062 .6737 62 LEU 62 -2.6981 .6031 999.9900 999.9900 .8331 -.4206 .7068 .6622 .6808 .0214 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7068 .6407 .6683 .3752 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7068 .6120 .6515 .3085 65 GLU 65 -1.3222 -.7281 999.9900 -1.0323 .6899 -.5982 .7065 .7035 .7048 -.1638 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7065 .7063 .7064 .7158 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7067 .7037 .7050 .8109 68 ALA 68 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7060 .7052 .7055 .7393 69 ARG 69 .8354 -.2494 999.9900 .6901 .8581 .5649 .7067 .7024 .7042 .6048 70 VAL 70 .2188 999.9900 .4980 999.9900 .7810 .4993 .7063 .7064 .7063 .5821 71 GLN 71 -.6834 -2.2325 999.9900 3.6599 .5113 .3138 .7061 .7033 .7045 .4441 72 GLY 72 1.0801 999.9900 999.9900 999.9900 .8277 .9539 .7060 .7050 .7054 .8297 73 GLN 73 -.8581 -2.2325 999.9900 1.3059 .7898 -.2487 .7071 .7029 .7046 .0692 74 ARG 74 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .7066 .6530 .6753 -.4639 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7049 .6187 .6546 -.1358 76 GLY 76 .9055 999.9900 999.9900 999.9900 .8897 .8976 .7067 .7051 .7058 .8018 77 SER 77 .1787 999.9900 -.7153 999.9900 .6705 .0446 .7064 .6586 .6785 .2998 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7065 .6083 .6492 -.1380 79 GLU 79 .8733 -.5796 999.9900 -1.0323 .6899 -.0122 .7066 .7028 .7044 .2268 80 GLU 80 -.2011 -.2267 999.9900 .3501 .6899 .1530 .7065 .7029 .7044 .3369 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7060 .7057 .7058 .5538 82 ALA 82 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7067 .7040 .7051 .5918 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7059 .7055 .7057 .4306 84 LEU 84 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7065 .7013 .7035 .0542 85 VAL 85 .5660 999.9900 .1416 999.9900 .7810 .4962 .7065 .7060 .7062 .5802 86 ASP 86 1.3227 -1.9171 999.9900 999.9900 .8104 .0720 .7053 .7036 .7043 .3250 87 GLY 87 -1.0419 999.9900 999.9900 999.9900 .8277 -.1071 .7057 .7055 .7056 .2992 88 LEU 88 -.3532 .3561 999.9900 999.9900 .9565 .3198 .7054 .7029 .7039 .4736 89 ARG 89 -.1156 -1.3337 999.9900 .1593 .8581 -.0545 .7070 .7031 .7047 .1625 90 ARG 90 -2.5097 -.8928 999.9900 .1593 .8581 -.4452 .7062 .7030 .7043 -.1167 91 GLU 91 -.6240 -1.0407 999.9900 .3501 .6899 -.1562 .7059 .6515 .6742 .1221 92 PRO 92 -2.8996 999.9900 999.9900 999.9900 .4496 -1.2250 .7053 .6158 .6530 -.2822 93 GLY 93 -1.5840 999.9900 999.9900 999.9900 .8277 -.3782 .7069 .7058 .7063 .1641 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7068 .5596 .6437 .6332 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8897 .8897 .7070 .7060 .7065 .7676 96 SER 302 -.3025 999.9900 .3727 999.9900 .6705 .2469 .7069 .7015 .7038 .4298 97 ASP 303 -.8891 -2.3194 999.9900 999.9900 .8104 -.7994 .7069 .6564 .6775 -.2069 98 PRO 304 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7043 .6206 .6554 .4062 99 GLY 305 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7065 .6576 .6793 .4347 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7055 .6148 .6526 .3412 101 GLU 307 .1449 -.8169 999.9900 -1.0323 .6899 -.2536 .7062 .7027 .7042 .0658 102 ALA 308 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7065 .7055 .7059 .7019 103 ALA 309 .7636 999.9900 999.9900 999.9900 .8416 .8026 .7070 .7058 .7063 .7545 104 ARG 310 .6041 .5490 999.9900 .6901 .8581 .6783 .7057 .7031 .7042 .6857 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7067 .7036 .7049 -.0036 106 ARG 312 .6323 1.0858 999.9900 .1593 .6728 .5419 .7061 .7023 .7039 .5883 107 PHE 313 1.0502 -1.1947 999.9900 999.9900 .7573 .2043 .7067 .7036 .7048 .4046 108 ARG 314 -.4439 -.5225 999.9900 .1593 .6728 .0050 .7057 .7029 .7041 .2048 109 CYS 315 -.2798 999.9900 .1296 999.9900 .4013 .0837 .7067 .7034 .7048 .3323 110 PHE 316 -.4296 .8308 999.9900 999.9900 .7573 .3862 .7060 .7020 .7037 .5133 111 HIS 317 -.1228 -2.4183 999.9900 999.9900 .5967 -.6481 .7062 .7030 .7043 -.1070 112 TYR 318 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7065 .7036 .7048 .3045 113 GLU 319 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7062 .7029 .7043 -.2480 114 GLU 320 .0468 .1870 999.9900 .3501 .6899 .3185 .7069 .7034 .7048 .4473 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7067 .7050 .7057 .6844 116 THR 322 -.2485 999.9900 -.8810 999.9900 .4476 -.2273 .7053 .7062 .7058 .1459 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7065 .6598 .6806 .1564 118 PRO 324 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7062 .6104 .6503 .3403 119 GLN 325 .8469 .1064 999.9900 1.3059 .5113 .6926 .7067 .7034 .7048 .6968 120 GLU 326 .8733 -1.5476 999.9900 -1.0323 .6899 -.2542 .7064 .7034 .7047 .0655 121 ALA 327 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7057 .7055 .7056 .5754 122 LEU 328 .8182 .1975 999.9900 999.9900 .8331 .6163 .7061 .7031 .7044 .6516 123 ALA 329 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7067 .7047 .7055 .6843 124 GLN 330 .1030 -1.6169 999.9900 1.3059 .5113 .0758 .7063 .7037 .7048 .2856 125 LEU 331 .6509 -.0234 999.9900 999.9900 .9565 .5280 .7069 .7035 .7049 .5989 126 ARG 332 1.0056 .7158 999.9900 1.1817 .8581 .9886 .7067 .7035 .7048 .9076 127 GLU 333 .6833 -2.8418 999.9900 -1.0323 .6899 -.6253 .7052 .7029 .7038 -.1822 128 LEU 334 -.1421 -.0413 999.9900 999.9900 .8331 .2165 .7054 .7031 .7040 .4116 129 CYS 335 .6740 999.9900 .1296 999.9900 .4013 .4016 .7068 .7040 .7052 .5231 130 ARG 336 .8469 -2.8571 999.9900 .1593 .8581 -.1667 .7067 .7033 .7047 .0824 131 GLN 337 .0311 -2.6982 999.9900 1.3059 .5113 -.2125 .7066 .7030 .7045 .0933 132 TRP 338 -1.4299 -3.3859 999.9900 999.9900 .9378 -1.2927 .7054 .7024 .7037 -.4940 133 LEU 339 .0401 -1.7966 999.9900 999.9900 .9565 -.2667 .7069 .7031 .7047 .1220 134 ARG 340 -2.9267 -1.5080 999.9900 .1593 .8581 -.6516 .7066 .6543 .6761 -.2710 135 PRO 341 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7059 .6148 .6528 .3090 136 GLU 342 -.1289 -1.1891 999.9900 -1.0323 .6899 -.4151 .7065 .7033 .7046 -.0418 137 VAL 343 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7068 .7061 .7064 -.0390 138 ARG 344 -.4945 -1.0274 999.9900 .1593 .6728 -.1061 .7064 .7034 .7046 .1256 139 SER 345 -.4961 999.9900 -.7153 999.9900 .7781 -.1444 .7065 .7023 .7041 .1951 140 LYS 346 .2805 -.3112 999.9900 .3240 .7460 .2727 .7064 .7027 .7043 .3961 141 GLU 347 .8604 -.3402 999.9900 -1.0323 .6899 .0444 .7058 .7028 .7040 .2644 142 GLN 348 1.2265 -1.7668 999.9900 1.3059 .5113 .3192 .7066 .7029 .7045 .4477 143 MET 349 .8434 -2.5481 999.9900 .9587 .5203 -.0564 .7064 .7030 .7045 .1973 144 LEU 350 .2355 -2.5464 999.9900 999.9900 .8331 -.4926 .7058 .7032 .7043 -.0137 145 GLU 351 .8733 -1.1891 999.9900 2.1776 .6899 .6379 .7068 .7022 .7041 .6601 146 LEU 352 .4996 -1.0979 999.9900 999.9900 .9565 .1194 .7056 .7032 .7042 .3534 147 LEU 353 .6509 -1.6462 999.9900 999.9900 .8331 -.0541 .7064 .7017 .7037 .2492 148 VAL 354 .1911 999.9900 .9747 999.9900 .7810 .6489 .7064 .7058 .7060 .6718 149 LEU 355 .9913 -2.9612 999.9900 999.9900 .9565 -.3378 .7058 .7031 .7042 .0791 150 GLU 356 .0908 -2.1111 999.9900 -1.0323 .6899 -.5907 .7064 .7030 .7044 -.1589 151 GLN 357 .6461 -1.7668 999.9900 1.3059 .5113 .1741 .7067 .7040 .7051 .3512 152 PHE 358 .7853 .6387 999.9900 999.9900 .7573 .7271 .7048 .7032 .7038 .7178 153 LEU 359 .4996 -1.3405 999.9900 999.9900 .8331 -.0026 .7057 .7030 .7041 .2802 154 GLY 360 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7068 .7054 .7061 .6125 155 ALA 361 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7065 .7058 .7061 .6736 156 LEU 362 -2.6981 .8710 999.9900 999.9900 .8331 -.3313 .7065 .6553 .6766 .0736 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7063 .6381 .6665 .3744 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7059 .6044 .6467 .3064 159 GLU 365 -1.3222 -.7281 999.9900 -1.0323 .6899 -.5982 .7059 .7031 .7042 -.1640 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7067 .7065 .7066 .7159 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7066 .7039 .7050 .8109 162 ALA 368 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7068 .7054 .7060 .7395 163 ARG 369 .8354 -.2494 999.9900 .6901 .8581 .5649 .7057 .7032 .7043 .6048 164 VAL 370 .2188 999.9900 .4980 999.9900 .7810 .4993 .7065 .7057 .7060 .5820 165 GLN 371 -.6834 -2.2325 999.9900 3.6599 .5113 .3138 .7066 .7037 .7049 .4443 166 GLY 372 1.0801 999.9900 999.9900 999.9900 .8277 .9539 .7063 .7040 .7050 .8295 167 GLN 373 -.8581 -2.2325 999.9900 1.3059 .5113 -.3184 .7062 .7040 .7049 .0228 168 ARG 374 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .7064 .6607 .6798 -.4629 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7061 .6116 .6510 -.1373 170 GLY 376 .9055 999.9900 999.9900 999.9900 .8277 .8666 .7068 .7051 .7059 .7863 171 SER 377 .1787 999.9900 -.7153 999.9900 .6705 .0446 .7060 .6550 .6762 .2990 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7061 .6001 .6442 -.1402 173 GLU 379 .8733 -.5796 999.9900 -1.0323 .6899 -.0122 .7065 .7026 .7043 .2267 174 GLU 380 -.2011 -.2267 999.9900 -1.0323 .6899 -.1926 .7064 .7028 .7043 .1065 175 ALA 381 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7051 .7058 .6844 176 ALA 382 .3573 999.9900 999.9900 999.9900 .7458 .5516 .7067 .7055 .7060 .6288 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7056 .7050 .7053 .4304 178 LEU 384 1.1349 -2.9612 999.9900 999.9900 .8331 -.3311 .7062 .7029 .7043 .0832 179 VAL 385 .9834 999.9900 .5873 999.9900 .8960 .8223 .7060 .7061 .7061 .7758 180 ASP 386 .3915 -.9083 999.9900 999.9900 .8104 .0979 .7058 .7042 .7048 .3407 181 GLY 387 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7056 .7055 .7056 .4465 182 LEU 388 -.3532 .3561 999.9900 999.9900 .9565 .3198 .7064 .7036 .7047 .4739 183 ARG 389 -.1156 -1.5080 999.9900 .1593 .8581 -.0894 .7062 .7033 .7045 .1375 184 ARG 390 -2.5097 -.8928 999.9900 .1593 .8581 -.4452 .7069 .7026 .7044 -.1166 185 GLU 391 -.6240 -1.0407 999.9900 1.1588 .6899 .0460 .7064 .6601 .6794 .2584 186 PRO 392 -2.8996 999.9900 999.9900 999.9900 .4496 -1.2250 .7067 .6195 .6558 -.2809 187 GLY 393 -1.5840 999.9900 999.9900 999.9900 .8277 -.3782 .7039 .7052 .7046 .1632 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7069 .7054 .7061 .7061 Means: -.0761 -1.1379 .0130 .4011 .7161 .0487 .7063 .6909 .6973 .3005 2.00 analyzed_20