1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8897 .8897 .7064 .7061 .7063 .7674 2 SER 2 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .7060 .7035 .7045 -.4790 3 ASP 3 -2.5838 .9074 999.9900 999.9900 .8104 -.2887 .7062 .6587 .6785 .0998 4 PRO 4 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7068 .6147 .6531 .3093 5 GLY 5 -1.1609 999.9900 999.9900 999.9900 .7883 -.1863 .7064 .6555 .6781 .2473 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7064 .6092 .6497 .3400 7 GLU 7 .8733 -2.3808 999.9900 -1.0323 .6899 -.4625 .7064 .7026 .7042 -.0735 8 ALA 8 .7636 999.9900 999.9900 999.9900 .7458 .7547 .7065 .7056 .7060 .7304 9 ALA 9 .7636 999.9900 999.9900 999.9900 .7458 .7547 .7069 .7044 .7055 .7302 10 ARG 10 .6041 .0684 999.9900 .1593 .8581 .3699 .7052 .7027 .7037 .4653 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7066 .7033 .7047 -.0037 12 ARG 12 .8354 .6306 999.9900 1.0856 .8581 .8991 .7061 .7028 .7042 .8435 13 PHE 13 1.1962 -1.8165 999.9900 999.9900 .7573 .0457 .7066 .7026 .7043 .3092 14 ARG 14 .1485 -.9348 999.9900 .1593 .8581 .0781 .7060 .7031 .7043 .2571 15 CYS 15 .2727 999.9900 .1296 999.9900 .4013 .2679 .7068 .7032 .7047 .4427 16 PHE 16 -1.4107 -.6308 999.9900 999.9900 .7573 -.4281 .7068 .7022 .7041 .0250 17 HIS 17 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7064 .7035 .7047 -.1527 18 TYR 18 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7065 .7043 .7052 .3046 19 GLU 19 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7060 .7032 .7044 -.2480 20 GLU 20 .0468 -.0757 999.9900 -1.0323 1.0761 .0037 .7058 .7031 .7043 .2373 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7064 .7052 .7057 .7083 22 THR 22 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7059 .7064 .7062 .1510 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .8277 -.3507 .7066 .6608 .6811 .1665 24 PRO 24 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7066 .6040 .6467 .1616 25 GLN 25 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7065 .7032 .7046 .2559 26 GLU 26 .5470 -1.5476 999.9900 .3501 .6899 .0098 .7066 .7025 .7042 .2414 27 ALA 27 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7064 .7059 .7061 .7455 28 LEU 28 .8182 .1975 999.9900 999.9900 .8331 .6163 .7067 .7032 .7047 .6518 29 ALA 29 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7066 .7053 .7058 .7455 30 GLN 30 .9013 -2.2325 999.9900 1.3059 .5113 .1215 .7070 .7031 .7047 .3160 31 LEU 31 1.1349 -.1732 999.9900 999.9900 .9565 .6394 .7065 .7027 .7043 .6655 32 ARG 32 1.0056 .8024 999.9900 .1593 .6728 .5599 .7052 .7022 .7035 .6010 33 GLU 33 1.0761 -2.8418 999.9900 1.1588 .6899 .0207 .7062 .7022 .7038 .2485 34 LEU 34 .8442 .3561 999.9900 999.9900 .9565 .7190 .7056 .7029 .7040 .7131 35 CYS 35 1.4696 999.9900 .1296 999.9900 .4013 .6668 .7065 .7030 .7044 .6820 36 ARG 36 .6041 -2.3766 999.9900 .1593 .6728 -.1562 .7066 .7034 .7047 .0899 37 GLN 37 -.1264 -2.2325 999.9900 1.3059 .5113 -.1354 .7039 .7032 .7035 .1442 38 TRP 38 -1.3140 -1.9067 999.9900 999.9900 .9378 -.7610 .7061 .7041 .7049 -.1745 39 LEU 39 -.8032 -2.9612 999.9900 999.9900 .9565 -.9359 .7059 .7020 .7036 -.2800 40 ARG 40 -2.5097 -1.5080 999.9900 .1593 .8581 -.5682 .7066 .6550 .6765 -.2113 41 PRO 41 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7064 .6074 .6487 .4034 42 GLU 42 -.1289 -.8834 999.9900 -1.0323 .6899 -.3387 .7054 .7021 .7035 .0088 43 VAL 43 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7069 .7059 .7063 -.0390 44 ARG 44 -.7709 -.1044 999.9900 1.0856 .6728 .3937 .7068 .7037 .7050 .4827 45 SER 45 -1.2908 999.9900 -.7153 999.9900 .6705 -.4452 .7068 .7020 .7040 .0146 46 LYS 46 .7090 .0549 999.9900 -.4035 .7460 .1406 .7054 .7030 .7040 .3016 47 GLU 47 .8733 -1.3104 999.9900 -1.0323 .6899 -.1949 .7061 .7015 .7035 .1047 48 GLN 48 .7451 .1167 999.9900 2.7911 .5113 1.0410 .7069 .7031 .7047 .9290 49 MET 49 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7067 .7032 .7047 .1912 50 LEU 50 .2355 -2.5464 999.9900 999.9900 .9565 -.4514 .7062 .7026 .7041 .0109 51 GLU 51 .7157 -1.0407 999.9900 .3501 .6899 .1788 .7051 .7031 .7039 .3539 52 LEU 52 .8786 -1.8410 999.9900 999.9900 .9565 -.0020 .7063 .7031 .7044 .2807 53 LEU 53 .4996 -.6965 999.9900 999.9900 .8331 .2121 .7063 .7023 .7039 .4089 54 VAL 54 .7683 999.9900 -.2457 999.9900 .7810 .4346 .7066 .7059 .7062 .5432 55 LEU 55 1.1349 -.3936 999.9900 999.9900 .8331 .5248 .7069 .7028 .7045 .5968 56 GLU 56 .7157 -2.1111 999.9900 -1.0323 .6899 -.4345 .7056 .7036 .7044 -.0548 57 GLN 57 .9013 -1.0287 999.9900 1.3059 .5113 .4224 .7067 .7039 .7051 .5167 58 PHE 58 .7853 .5389 999.9900 999.9900 .7573 .6938 .7064 .7025 .7042 .6981 59 LEU 59 .8475 .5402 999.9900 999.9900 .8331 .7403 .7061 .7030 .7043 .7260 60 GLY 60 -.2363 999.9900 999.9900 999.9900 .7883 .2760 .7068 .7049 .7057 .4909 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7057 .7057 .7057 .4997 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7069 .6529 .6754 -.0298 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7063 .6420 .6688 .3754 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7066 .6054 .6476 .3069 65 GLU 65 -1.3222 -1.2470 999.9900 -1.0323 .6899 -.7279 .7067 .7032 .7046 -.2503 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7068 .7066 .7067 .7160 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7065 .7037 .7049 .8109 68 ALA 68 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7069 .7053 .7060 .7395 69 ARG 69 .8354 .0684 999.9900 .1593 .8581 .4161 .7068 .7027 .7044 .4986 70 VAL 70 .8065 999.9900 -.0276 999.9900 .7810 .5200 .7070 .7056 .7062 .5945 71 GLN 71 .7451 -1.7668 999.9900 1.3059 .5113 .1989 .7066 .7041 .7051 .3677 72 GLY 72 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7071 .7041 .7054 .5383 73 GLN 73 -2.3919 -2.6982 999.9900 1.3059 .7898 -.7486 .7067 .7036 .7049 -.2640 74 ARG 74 -1.7561 .1080 999.9900 .1593 .8581 -.0943 .7062 .6516 .6743 .1266 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7059 .6082 .6489 -.1382 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8277 .5136 .7068 .7060 .7064 .6100 77 SER 77 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7063 .6509 .6739 .1779 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7057 .6076 .6485 -.1384 79 GLU 79 1.0761 .3956 999.9900 -1.0323 .6899 .2823 .7060 .7037 .7047 .4232 80 GLU 80 .1885 -.6022 999.9900 1.7325 .6899 .5022 .7062 .7038 .7048 .5698 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7070 .7051 .7058 .5539 82 ALA 82 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7070 .7053 .7060 .5922 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7057 .7048 .7052 .4304 84 LEU 84 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7061 .7025 .7040 .0198 85 VAL 85 .5660 999.9900 -.0276 999.9900 .7810 .4398 .7069 .7061 .7064 .5465 86 ASP 86 1.1285 -2.0928 999.9900 999.9900 .8104 -.0513 .7055 .7029 .7040 .2509 87 GLY 87 -.5009 999.9900 999.9900 999.9900 .7883 .1437 .7050 .7054 .7052 .4245 88 LEU 88 .8442 .3561 999.9900 999.9900 .9565 .7190 .7069 .7035 .7049 .7135 89 ARG 89 .3315 -.5225 999.9900 .1593 .6728 .1601 .7061 .7033 .7045 .3157 90 ARG 90 -1.0149 -2.8571 999.9900 .7862 .6728 -.3254 .7063 .7032 .7045 -.0311 91 GLU 91 -2.8104 -2.1111 999.9900 -1.0323 .6899 -1.3160 .7063 .6539 .6757 -.6506 92 PRO 92 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7059 .6152 .6530 .1642 93 GLY 93 -2.4582 999.9900 999.9900 999.9900 .7883 -.8350 .7060 .7062 .7061 -.0645 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7055 .5612 .6437 .6334 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7044 .7061 .7053 .7460 96 SER 302 -3.7598 999.9900 -.7153 999.9900 .6705 -1.2682 .7064 .7029 .7044 -.4791 97 ASP 303 -2.5838 .9074 999.9900 999.9900 .8104 -.2887 .7065 .6607 .6798 .1002 98 PRO 304 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7062 .6237 .6581 .3113 99 GLY 305 -1.1609 999.9900 999.9900 999.9900 .7883 -.1863 .7067 .6568 .6790 .2477 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7062 .6035 .6463 .3385 101 GLU 307 .8733 -2.3808 999.9900 -1.0323 1.0761 -.3659 .7059 .7030 .7042 -.0091 102 ALA 308 .3637 999.9900 999.9900 999.9900 .7458 .5548 .7071 .7055 .7062 .6305 103 ALA 309 .7636 999.9900 999.9900 999.9900 .8416 .8026 .7067 .7055 .7060 .7544 104 ARG 310 .6041 .0684 999.9900 .6901 .8581 .5821 .7065 .7021 .7039 .6170 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7066 .7025 .7042 -.0038 106 ARG 312 .8354 .6306 999.9900 1.0856 .6728 .8620 .7068 .7025 .7043 .8170 107 PHE 313 1.1962 -.2975 999.9900 999.9900 .8629 .5872 .7065 .7030 .7045 .6342 108 ARG 314 .1485 -.9348 999.9900 .1593 .8581 .0781 .7059 .7031 .7042 .2571 109 CYS 315 -.2798 999.9900 .1296 999.9900 .4013 .0837 .7069 .7034 .7049 .3323 110 PHE 316 -1.4107 .8308 999.9900 999.9900 .7573 .0591 .7063 .7033 .7045 .3174 111 HIS 317 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7055 .7036 .7044 -.1528 112 TYR 318 -.1387 .2264 999.9900 999.9900 .5630 .2169 .7067 .7035 .7048 .4122 113 GLU 319 -.8041 -1.6501 999.9900 1.1588 .3568 -.2347 .7066 .7024 .7041 .0784 114 GLU 320 .0468 -.0757 999.9900 -1.0323 .6899 -.0928 .7056 .7032 .7042 .1729 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7062 .7035 .7046 .6839 116 THR 322 -.2237 999.9900 -.2947 999.9900 .4476 -.0236 .7070 .7062 .7065 .2685 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7066 .6609 .6812 .1567 118 PRO 324 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7063 .6053 .6474 .1619 119 GLN 325 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7066 .7035 .7048 .2559 120 GLU 326 .5470 -1.5476 999.9900 -1.0323 .6899 -.3358 .7066 .7028 .7044 .0111 121 ALA 327 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7060 .7051 .7055 .5754 122 LEU 328 .0926 .1975 999.9900 999.9900 .8331 .3744 .7063 .7034 .7046 .5066 123 ALA 329 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7067 .7059 .7062 .6846 124 GLN 330 -.3431 -2.2325 999.9900 1.3059 .5113 -.1896 .7065 .7032 .7046 .1085 125 LEU 331 1.1349 -.1732 999.9900 999.9900 .9565 .6394 .7064 .7025 .7041 .6654 126 ARG 332 1.0056 .8024 999.9900 .1593 .8581 .5969 .7064 .7026 .7042 .6277 127 GLU 333 .8733 -2.8418 999.9900 -1.0323 .6899 -.5777 .7053 .7035 .7043 -.1504 128 LEU 334 .8442 .3561 999.9900 999.9900 .9565 .7190 .7063 .7033 .7045 .7133 129 CYS 335 1.4696 999.9900 .1296 999.9900 .4013 .6668 .7065 .7034 .7047 .6821 130 ARG 336 .6041 -2.3766 999.9900 .1593 .8581 -.1191 .7069 .7025 .7044 .1162 131 GLN 337 -.1264 -2.2325 999.9900 1.3059 .5113 -.1354 .7060 .7044 .7051 .1448 132 TRP 338 -.4530 -1.6686 999.9900 999.9900 .9378 -.3946 .7053 .7041 .7046 .0451 133 LEU 339 -.7230 -2.9612 999.9900 999.9900 .8331 -.9503 .7063 .7029 .7043 -.2884 134 ARG 340 -2.9267 -1.5080 999.9900 .1593 .8581 -.6516 .7068 .6536 .6757 -.2711 135 PRO 341 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7068 .6204 .6564 .3107 136 GLU 342 -.1289 -.8834 999.9900 -1.0323 .6899 -.3387 .7066 .7039 .7050 .0093 137 VAL 343 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7070 .7064 .7067 -.0389 138 ARG 344 -.6106 .2472 999.9900 1.0856 .6728 .4961 .7058 .7036 .7045 .5557 139 SER 345 -1.1635 999.9900 -.7153 999.9900 .6705 -.4028 .7068 .7031 .7046 .0403 140 LYS 346 .9451 -.3112 999.9900 -.0397 .7460 .2601 .7068 .7023 .7042 .3871 141 GLU 347 .8604 -1.3104 999.9900 .3501 .6899 .1475 .7057 .7031 .7041 .3331 142 GLN 348 1.2265 .1167 999.9900 1.3059 .5113 .7901 .7068 .7039 .7051 .7618 143 MET 349 .9193 -2.5481 999.9900 1.7963 .5203 .1719 .7064 .7031 .7044 .3495 144 LEU 350 .2355 -2.5464 999.9900 999.9900 .9565 -.4514 .7064 .7022 .7040 .0109 145 GLU 351 .1185 -1.0407 999.9900 -1.0323 .6899 -.3162 .7060 .7029 .7042 .0240 146 LEU 352 .8786 -1.9980 999.9900 999.9900 .8331 -.0954 .7060 .7028 .7042 .2245 147 LEU 353 .8475 -.6965 999.9900 999.9900 .8331 .3280 .7057 .7033 .7043 .4786 148 VAL 354 .1911 999.9900 .7395 999.9900 .7810 .5705 .7062 .7060 .7061 .6248 149 LEU 355 1.1349 -.3936 999.9900 999.9900 .9565 .5659 .7066 .7008 .7032 .6210 150 GLU 356 .7157 -2.1111 999.9900 -1.0323 .6899 -.4345 .7061 .7032 .7044 -.0548 151 GLN 357 .9013 -1.0287 999.9900 1.3059 .5113 .4224 .7067 .7034 .7048 .5166 152 PHE 358 .7853 .5389 999.9900 999.9900 .7573 .6938 .7064 .7031 .7045 .6982 153 LEU 359 .4996 .5402 999.9900 999.9900 .8331 .6243 .7061 .7022 .7038 .6562 154 GLY 360 -.2363 999.9900 999.9900 999.9900 .7883 .2760 .7064 .7059 .7062 .4911 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7069 .7055 .7061 .5000 156 LEU 362 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7064 .6568 .6775 -.0291 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7068 .6424 .6693 .3756 158 PRO 364 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7064 .6090 .6495 .4038 159 GLU 365 -1.3222 -1.2470 999.9900 .3501 .6899 -.3823 .7064 .7029 .7043 -.0200 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7062 .7060 .7061 .7157 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7059 .7035 .7045 .8107 162 ALA 368 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7069 .7049 .7057 .7634 163 ARG 369 .8354 -.2494 999.9900 .1593 .8581 .3526 .7052 .7034 .7042 .4531 164 VAL 370 .8065 999.9900 .1416 999.9900 .7810 .5764 .7069 .7063 .7065 .6285 165 GLN 371 .7451 -1.6169 999.9900 1.3059 .5113 .2364 .7056 .7033 .7043 .3924 166 GLY 372 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7067 .7039 .7051 .5381 167 GLN 373 -2.3919 -2.6982 999.9900 1.3059 .5113 -.8182 .7068 .7034 .7048 -.3105 168 ARG 374 -1.7561 .1080 999.9900 .1593 .8581 -.0943 .7067 .6487 .6728 .1263 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7065 .6205 .6563 -.1350 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8277 .5136 .7068 .7051 .7058 .6098 171 SER 377 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7064 .6537 .6756 .1784 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7066 .6103 .6504 -.1375 173 GLU 379 1.0761 .3956 999.9900 -1.0323 .6899 .2823 .7057 .7035 .7044 .4231 174 GLU 380 .1885 -.6022 999.9900 1.1588 .6899 .3587 .7065 .7033 .7046 .4741 175 ALA 381 .0579 999.9900 999.9900 999.9900 .7881 .4230 .7069 .7050 .7058 .5645 176 ALA 382 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7069 .7057 .7062 .5923 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7064 .7048 .7055 .4306 178 LEU 384 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7061 .7021 .7038 .0197 179 VAL 385 .5660 999.9900 .1416 999.9900 .8960 .5345 .7061 .7061 .7061 .6032 180 ASP 386 1.1285 -2.0928 999.9900 999.9900 .8104 -.0513 .7060 .7043 .7050 .2513 181 GLY 387 -.5009 999.9900 999.9900 999.9900 .7883 .1437 .7060 .7059 .7060 .4248 182 LEU 388 .8442 .3561 999.9900 999.9900 .9565 .7190 .7064 .7039 .7049 .7134 183 ARG 389 .3315 -.5225 999.9900 .1593 .8581 .1972 .7070 .7027 .7045 .3422 184 ARG 390 -1.0149 -2.8571 999.9900 .7862 .8581 -.2883 .7068 .7040 .7051 -.0044 185 GLU 391 -2.8104 -2.1111 999.9900 -1.0323 .6899 -1.3160 .7067 .6554 .6768 -.6503 186 PRO 392 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7055 .6160 .6533 .1643 187 GLY 393 -2.4582 999.9900 999.9900 999.9900 .8277 -.8153 .7067 .7056 .7061 -.0546 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7069 .7042 .7056 .7056 Means: -.1004 -1.0112 -.2141 .3289 .7136 .0454 .7063 .6906 .6972 .2985 2.00 analyzed_6