1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8897 .8897 .7060 .7062 .7061 .7673 2 SER 2 -.1368 999.9900 -.7153 999.9900 .6705 -.0606 .7069 .7023 .7042 .2455 3 ASP 3 -.5648 -1.7105 999.9900 999.9900 .8104 -.4883 .7067 .6519 .6748 -.0212 4 PRO 4 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7060 .6121 .6512 .4130 5 GLY 5 -.2842 999.9900 999.9900 999.9900 .7883 .2520 .7062 .6548 .6777 .4663 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7065 .6146 .6529 .3414 7 GLU 7 .6833 -.3402 999.9900 -1.0323 .6899 .0002 .7065 .7033 .7046 .2351 8 ALA 8 .6496 999.9900 999.9900 999.9900 .7458 .6977 .7064 .7047 .7054 .7016 9 ALA 9 .7636 999.9900 999.9900 999.9900 .8416 .8026 .7066 .7055 .7060 .7543 10 ARG 10 .6041 .4622 999.9900 .1593 .8581 .4486 .7056 .7031 .7041 .5217 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7060 .7025 .7039 -.0040 12 ARG 12 .1485 .6306 999.9900 .1593 .6728 .3541 .7060 .7030 .7043 .4542 13 PHE 13 .8041 -2.0028 999.9900 999.9900 .8629 -.1119 .7062 .7029 .7043 .2147 14 ARG 14 .1485 -1.0274 999.9900 .1593 .8581 .0596 .7056 .7022 .7036 .2437 15 CYS 15 .2727 999.9900 .1296 999.9900 .4013 .2679 .7063 .7031 .7044 .4426 16 PHE 16 -1.4107 -.1636 999.9900 999.9900 .7573 -.2723 .7066 .7036 .7048 .1186 17 HIS 17 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7055 .7029 .7040 -.1530 18 TYR 18 -.1387 -.5584 999.9900 999.9900 .5630 -.0447 .7068 .7037 .7050 .2553 19 GLU 19 -.8041 -1.4588 999.9900 .3501 .6899 -.3057 .7057 .7026 .7039 .0309 20 GLU 20 .0468 -.0757 999.9900 .3501 .6899 .2528 .7064 .7030 .7044 .4034 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7066 .7055 .7060 .7084 22 THR 22 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7070 .7060 .7064 .1512 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .8277 -.3507 .7065 .6637 .6827 .1672 24 PRO 24 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7066 .6151 .6532 .1644 25 GLN 25 .8469 -2.6982 999.9900 1.3059 .7898 .0611 .7064 .7043 .7052 .2758 26 GLU 26 .5470 -1.4588 999.9900 .3501 1.0761 .1286 .7062 .7030 .7043 .3206 27 ALA 27 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7067 .7060 .7063 .7456 28 LEU 28 .8182 .5655 999.9900 999.9900 .8331 .7389 .7066 .7023 .7041 .7252 29 ALA 29 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7054 .7060 .6845 30 GLN 30 .1338 -1.6169 999.9900 1.3059 .5113 .0835 .7057 .7028 .7040 .2904 31 LEU 31 .6296 -.1732 999.9900 999.9900 .9565 .4710 .7068 .7032 .7047 .5646 32 ARG 32 .6041 -.5720 999.9900 .1593 .8581 .2418 .7061 .7026 .7041 .3739 33 GLU 33 .0765 -1.3804 999.9900 .3501 .6899 -.0660 .7066 .7035 .7048 .1910 34 LEU 34 .6296 .6236 999.9900 999.9900 .9565 .7366 .7065 .7033 .7046 .7239 35 CYS 35 .6740 999.9900 .1296 999.9900 .4013 .4016 .7059 .7025 .7039 .5227 36 ARG 36 .9556 -2.3766 999.9900 .6901 .8581 .1635 .7060 .7029 .7042 .3180 37 GLN 37 .0311 -2.6982 999.9900 1.3059 .5113 -.2125 .7069 .7037 .7050 .0934 38 TRP 38 -.4530 -1.9067 999.9900 999.9900 .9378 -.4739 .7065 .7034 .7047 -.0024 39 LEU 39 -1.0430 -2.9612 999.9900 999.9900 .9565 -1.0159 .7068 .7025 .7043 -.3277 40 ARG 40 -2.9267 -1.1946 999.9900 .1593 .8581 -.5889 .7064 .6552 .6765 -.2261 41 PRO 41 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7066 .6071 .6486 .4034 42 GLU 42 -.1289 -.4051 999.9900 -1.0323 .6899 -.2191 .7067 .7034 .7048 .0889 43 VAL 43 -2.3613 999.9900 -.5532 999.9900 .7810 -.7112 .7065 .7060 .7062 -.1442 44 ARG 44 -.7709 -.3536 999.9900 .5548 .6728 .1316 .7069 .7024 .7043 .2953 45 SER 45 -.7998 999.9900 -.0289 999.9900 .6705 -.0527 .7062 .7026 .7041 .2501 46 LYS 46 -.1232 -2.9005 999.9900 .2868 .7460 -.3408 .7066 .7023 .7041 -.0422 47 GLU 47 .5470 -2.3808 999.9900 -1.0323 .6899 -.5441 .7065 .7027 .7043 -.1279 48 GLN 48 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7069 .7037 .7051 .2901 49 MET 49 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7052 .7029 .7039 .1909 50 LEU 50 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7060 .7027 .7041 .2202 51 GLU 51 .1185 .0727 999.9900 -1.0323 .6899 -.0378 .7064 .7032 .7046 .2097 52 LEU 52 .8786 -.0645 999.9900 999.9900 .8331 .5490 .7063 .7020 .7038 .6111 53 LEU 53 .4996 -.6965 999.9900 999.9900 .8331 .2121 .7058 .7020 .7036 .4088 54 VAL 54 .1911 999.9900 -.5532 999.9900 .7810 .1397 .7064 .7058 .7061 .3662 55 LEU 55 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7059 .7019 .7035 .0542 56 GLU 56 .0908 -1.6501 999.9900 -1.0323 .6899 -.4754 .7064 .7026 .7042 -.0821 57 GLN 57 .6461 -2.6982 999.9900 1.3059 .5113 -.0587 .7069 .7022 .7041 .1957 58 PHE 58 .7853 -.6308 999.9900 999.9900 .7573 .3040 .7053 .7032 .7041 .4641 59 LEU 59 .4996 -1.3405 999.9900 999.9900 .9565 .0385 .7050 .7026 .7036 .3046 60 GLY 60 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7069 .7055 .7061 .4468 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7065 .7054 .7058 .4998 62 LEU 62 -2.6981 .6031 999.9900 999.9900 .8331 -.4206 .7069 .6599 .6795 .0210 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7066 .6403 .6679 .3750 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7062 .6156 .6533 .3093 65 GLU 65 -1.3222 -.7281 999.9900 .3501 .6899 -.2526 .7064 .7032 .7045 .0666 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7068 .7063 .7065 .7159 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7050 .7041 .7045 .8194 68 ALA 68 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7066 .7052 .7058 .7634 69 ARG 69 .6323 .3075 999.9900 .6901 .8581 .6356 .7062 .7033 .7045 .6554 70 VAL 70 .8065 999.9900 .6672 999.9900 .7810 .7516 .7060 .7061 .7060 .7334 71 GLN 71 .7451 -1.7668 999.9900 1.3059 .5113 .1989 .7064 .7031 .7045 .3675 72 GLY 72 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7062 .7046 .7053 .5382 73 GLN 73 -2.2003 -1.7668 999.9900 1.3059 .5113 -.5375 .7067 .7038 .7051 -.1232 74 ARG 74 -1.7561 .1080 999.9900 1.0005 .8581 .2422 .7063 .6567 .6774 .3677 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7053 .6147 .6525 -.1367 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7065 .7057 .7061 .6254 77 SER 77 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7068 .6504 .6739 .1779 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7064 .6101 .6502 -.1376 79 GLU 79 1.0761 .3956 999.9900 -1.0323 .6899 .2823 .7063 .7029 .7043 .4231 80 GLU 80 .1885 -.6022 999.9900 .3501 1.0761 .2531 .7063 .7040 .7050 .4038 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7881 .4230 .7068 .7051 .7058 .5645 82 ALA 82 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7068 .7054 .7060 .5922 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7060 .7058 .7059 .4307 84 LEU 84 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7066 .7033 .7047 .0200 85 VAL 85 .5660 999.9900 -.2457 999.9900 .8960 .4054 .7068 .7061 .7064 .5258 86 ASP 86 1.1359 -2.8653 999.9900 999.9900 .8104 -.3063 .7061 .7043 .7050 .0983 87 GLY 87 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7064 .7061 .7063 .6126 88 LEU 88 -.9896 -1.3818 999.9900 999.9900 .8331 -.5128 .7065 .7030 .7045 -.0258 89 ARG 89 .6041 -.0184 999.9900 .1593 .6728 .3154 .7062 .7039 .7048 .4267 90 ARG 90 -1.6049 -1.6149 999.9900 .1593 .8581 -.4086 .7067 .7035 .7048 -.0904 91 GLU 91 -1.7894 -1.9198 999.9900 -1.0323 .6899 -1.0129 .7062 .6531 .6752 -.4487 92 PRO 92 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7064 .6178 .6547 -.3223 93 GLY 93 -1.4779 999.9900 999.9900 999.9900 .8277 -.3251 .7050 .7057 .7054 .1901 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7062 .5571 .6423 .6317 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7063 .7062 .7062 .7467 96 SER 302 -.1368 999.9900 -.7153 999.9900 .6705 -.0606 .7061 .7032 .7044 .2455 97 ASP 303 -.5648 -1.7105 999.9900 999.9900 .8104 -.4883 .7059 .6587 .6784 -.0200 98 PRO 304 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7055 .6089 .6492 .4121 99 GLY 305 -.2842 999.9900 999.9900 999.9900 .7883 .2520 .7070 .6589 .6803 .4675 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7051 .6056 .6471 .3388 101 GLU 307 .6833 -.3402 999.9900 -1.0323 .6899 .0002 .7069 .7029 .7046 .2351 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 .7052 .7059 .7543 104 ARG 310 .6041 .4622 999.9900 .1593 .8581 .4486 .7065 .7026 .7042 .5217 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7059 .7032 .7043 -.0038 106 ARG 312 .6655 1.0644 999.9900 .1593 .8581 .5813 .7070 .7035 .7049 .6167 107 PHE 313 .6090 -4.3038 999.9900 999.9900 .7573 -.9792 .7067 .7029 .7044 -.3056 108 ARG 314 .1485 -1.0274 999.9900 1.0005 .8581 .3961 .7065 .7031 .7045 .4843 109 CYS 315 .2727 999.9900 .1296 999.9900 .4013 .2679 .7069 .7027 .7044 .4427 110 PHE 316 -1.4107 -.6014 999.9900 999.9900 .7573 -.4183 .7064 .7031 .7045 .0309 111 HIS 317 -.3517 -2.4183 999.9900 999.9900 .5967 -.7244 .7055 .7034 .7043 -.1529 112 TYR 318 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7062 .7014 .7034 .3040 113 GLU 319 -1.0962 -1.4588 999.9900 -1.0323 .3568 -.8076 .7069 .7036 .7049 -.3033 114 GLU 320 .0468 -.0757 999.9900 .3501 1.0761 .3493 .7057 .7025 .7038 .4676 115 ALA 321 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7069 .7054 .7060 .7085 116 THR 322 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7058 .7062 .7061 .1510 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7070 .6614 .6817 .1569 118 PRO 324 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7063 .6104 .6504 .1631 119 GLN 325 .8469 -2.6982 999.9900 1.3059 .5113 -.0085 .7069 .7033 .7048 .2293 120 GLU 326 .8733 -1.4588 999.9900 -1.0323 1.0761 -.1354 .7068 .7025 .7043 .1446 121 ALA 327 .1446 999.9900 999.9900 999.9900 .7458 .4452 .7062 .7061 .7061 .5757 122 LEU 328 .8182 .1975 999.9900 999.9900 .8331 .6163 .7064 .7030 .7044 .6516 123 ALA 329 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7068 .7060 .7063 .6846 124 GLN 330 .1030 -1.7668 999.9900 1.3059 .5113 .0384 .7056 .7034 .7043 .2604 125 LEU 331 .6296 -.2454 999.9900 999.9900 .9565 .4469 .7055 .7034 .7043 .5499 126 ARG 332 .6041 -.3536 999.9900 .1593 .6728 .2484 .7068 .7034 .7048 .3789 127 GLU 333 .0765 -1.5476 999.9900 .3501 .6899 -.1078 .7056 .7023 .7037 .1628 128 LEU 334 -.1421 .6236 999.9900 999.9900 .8331 .4382 .7052 .7037 .7044 .5447 129 CYS 335 .6740 999.9900 .1296 999.9900 .4013 .4016 .7062 .7044 .7051 .5231 130 ARG 336 .9556 -2.3766 999.9900 .1593 .8581 -.0488 .7068 .7034 .7048 .1666 131 GLN 337 -.1264 -2.6982 999.9900 1.3059 .5113 -.2518 .7053 .7043 .7047 .0670 132 TRP 338 -.4530 -1.9067 999.9900 999.9900 .9378 -.4739 .7061 .7035 .7046 -.0025 133 LEU 339 -1.0430 -2.9612 999.9900 999.9900 .9565 -1.0159 .7065 .7026 .7042 -.3277 134 ARG 340 -2.9267 -1.1946 999.9900 .1593 .8581 -.5889 .7062 .6520 .6746 -.2266 135 PRO 341 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7063 .6009 .6448 .4018 136 GLU 342 -.1289 -1.3104 999.9900 .3501 .6899 -.0998 .7064 .7029 .7044 .1683 137 VAL 343 -1.8566 999.9900 -.5532 999.9900 .7810 -.5429 .7069 .7065 .7067 -.0431 138 ARG 344 -.7709 -.3536 999.9900 .7862 .6728 .2241 .7068 .7033 .7048 .3615 139 SER 345 -.7998 999.9900 -.0289 999.9900 .6705 -.0527 .7064 .7015 .7036 .2500 140 LYS 346 -.1232 -2.9005 999.9900 .2868 .7460 -.3408 .7065 .7029 .7044 -.0421 141 GLU 347 .5470 -2.3808 999.9900 -1.0323 .6899 -.5441 .7061 .7033 .7045 -.1278 142 GLN 348 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7065 .7036 .7048 .2900 143 MET 349 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7058 .7033 .7043 .1911 144 LEU 350 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7054 .7033 .7042 .2202 145 GLU 351 .1185 .0727 999.9900 -1.0323 .6899 -.0378 .7066 .7019 .7038 .2095 146 LEU 352 .8786 -.0645 999.9900 999.9900 .8331 .5490 .7054 .7018 .7033 .6109 147 LEU 353 .4996 -.6965 999.9900 999.9900 .8331 .2121 .7068 .7036 .7049 .4093 148 VAL 354 .1911 999.9900 -.5532 999.9900 .7810 .1397 .7064 .7062 .7063 .3663 149 LEU 355 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7067 .7019 .7039 .0544 150 GLU 356 .0908 -1.3104 999.9900 -1.0323 .6899 -.3905 .7065 .7033 .7047 -.0253 151 GLN 357 .6461 -2.6982 999.9900 2.7911 .5113 .3126 .7064 .7038 .7049 .4434 152 PHE 358 .7853 -.1636 999.9900 999.9900 .7573 .4597 .7064 .7032 .7045 .5577 153 LEU 359 .4996 -1.3405 999.9900 999.9900 .9565 .0385 .7049 .7030 .7038 .3047 154 GLY 360 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7070 .7046 .7057 .4466 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7066 .7056 .7060 .4999 156 LEU 362 -2.6981 .8710 999.9900 999.9900 .8331 -.3313 .7069 .6593 .6791 .0744 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7060 .6462 .6711 .3763 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7065 .6053 .6475 .3068 159 GLU 365 -1.3222 -.7281 999.9900 -1.0323 .6899 -.5982 .7065 .7037 .7048 -.1637 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7067 .7060 .7063 .7158 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7067 .7033 .7047 .8109 162 ALA 368 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7068 .7052 .7059 .7395 163 ARG 369 .6323 .3075 999.9900 1.4811 .8581 .9520 .7069 .7032 .7047 .8814 164 VAL 370 .8065 999.9900 .3968 999.9900 .7810 .6614 .7063 .7060 .7061 .6793 165 GLN 371 .7451 -1.7668 999.9900 1.3059 .5113 .1989 .7066 .7031 .7046 .3675 166 GLY 372 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7068 .7046 .7056 .5383 167 GLN 373 -2.3919 -.0565 999.9900 1.3059 .7898 -.0882 .7066 .7033 .7047 .1762 168 ARG 374 -1.7561 .1080 999.9900 1.0005 .8581 .2422 .7067 .6567 .6775 .3678 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7063 .6191 .6554 -.1354 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7068 .7045 .7055 .6252 171 SER 377 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7065 .6535 .6756 .1784 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7065 .6206 .6564 -.1349 173 GLU 379 1.0761 .0026 999.9900 -1.0323 .6899 .1841 .7061 .7036 .7046 .3577 174 GLU 380 .8733 -.6022 999.9900 -1.0323 .6899 -.0178 .7067 .7027 .7044 .2230 175 ALA 381 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7064 .7058 .7060 .6845 176 ALA 382 .8001 999.9900 999.9900 999.9900 .7458 .7729 .7067 .7056 .7061 .7396 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7059 .7055 .7056 .4306 178 LEU 384 .8475 -2.9612 999.9900 999.9900 .8331 -.4269 .7051 .7015 .7030 .0252 179 VAL 385 .5646 999.9900 -1.0788 999.9900 .7810 .0890 .7060 .7063 .7062 .3358 180 ASP 386 .8349 -1.9171 999.9900 999.9900 .7118 -.1235 .7066 .7033 .7046 .2079 181 GLY 387 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7063 .7052 .7057 .6123 182 LEU 388 -.9896 -1.3818 999.9900 999.9900 .9565 -.4717 .7065 .7026 .7042 -.0012 183 ARG 389 .9556 -.0184 999.9900 .1593 .8581 .4228 .7067 .7030 .7046 .5034 184 ARG 390 -1.6049 -1.6149 999.9900 .1593 .8581 -.4086 .7064 .7028 .7043 -.0906 185 GLU 391 -1.7894 -1.9198 999.9900 -1.0323 .6899 -1.0129 .7061 .6573 .6776 -.4480 186 PRO 392 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7063 .6257 .6593 -.3203 187 GLY 393 -1.4779 999.9900 999.9900 999.9900 .7883 -.3448 .7049 .7045 .7047 .1800 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7071 .7054 .7062 .7062 Means: -.1022 -1.1600 -.3318 .3251 .7220 .0149 .7063 .6908 .6973 .2799 2.00 analyzed_9