1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7070 .7062 .7066 .7469 2 SER 2 -2.9368 999.9900 -.7153 999.9900 .6705 -.9939 .7059 .7035 .7045 -.3144 3 ASP 3 -1.0941 -2.3194 999.9900 999.9900 .8104 -.8677 .7065 .6581 .6783 -.2477 4 PRO 4 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7037 .6221 .6561 .4064 5 GLY 5 -.4135 999.9900 999.9900 999.9900 .8277 .2071 .7070 .6596 .6806 .4452 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7066 .6124 .6517 .3409 7 GLU 7 .6833 -.4584 999.9900 -1.0323 .6899 -.0294 .7062 .7030 .7044 .2153 8 ALA 8 .6648 999.9900 999.9900 999.9900 .7458 .7053 .7064 .7048 .7054 .7054 9 ALA 9 .7636 999.9900 999.9900 999.9900 .7458 .7547 .7064 .7053 .7057 .7303 10 ARG 10 .6041 .1080 999.9900 .1593 .8581 .3778 .7048 .7031 .7038 .4710 11 LEU 11 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7063 .7039 .7049 -.0036 12 ARG 12 .6655 .0684 999.9900 1.0005 .8581 .7186 .7067 .7036 .7049 .7148 13 PHE 13 .6259 -2.0028 999.9900 999.9900 .7573 -.2065 .7067 .7036 .7049 .1581 14 ARG 14 .6655 -1.0788 999.9900 .1593 .6728 .1156 .7068 .7033 .7048 .2840 15 CYS 15 .2727 999.9900 .1296 999.9900 .4013 .2679 .7066 .7030 .7045 .4427 16 PHE 16 -.8057 -.4798 999.9900 999.9900 .7573 -.1760 .7060 .7033 .7044 .1762 17 HIS 17 -.2420 -2.4183 999.9900 999.9900 .5967 -.6879 .7056 .7039 .7046 -.1308 18 TYR 18 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7068 .7037 .7050 .3046 19 GLU 19 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7069 .7043 .7054 -.2477 20 GLU 20 .0468 1.1195 999.9900 1.1588 .6899 .7537 .7070 .7035 .7050 .7376 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7063 .7050 .7056 .7082 22 THR 22 -.2485 999.9900 -.8810 999.9900 .4476 -.2273 .7060 .7065 .7063 .1461 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7065 .6627 .6822 .1571 24 PRO 24 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7063 .6042 .6468 .1616 25 GLN 25 1.0064 -2.6982 999.9900 1.3059 .7898 .1010 .7065 .7039 .7049 .3024 26 GLU 26 .8171 -1.4588 999.9900 -1.0323 .6899 -.2460 .7062 .7034 .7046 .0709 27 ALA 27 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7061 .7054 .7057 .7454 28 LEU 28 .8182 .1975 999.9900 999.9900 .8331 .6163 .7064 .7018 .7037 .6514 29 ALA 29 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7066 .7057 .7061 .7456 30 GLN 30 .1338 -2.6982 999.9900 1.3059 .5113 -.1868 .7068 .7032 .7047 .1105 31 LEU 31 -.1421 -.1732 999.9900 999.9900 .9565 .2137 .7068 .7029 .7045 .4102 32 ARG 32 .6041 -.0419 999.9900 .1593 .8581 .3478 .7064 .7025 .7041 .4497 33 GLU 33 .6833 -.9194 999.9900 -1.0323 .6899 -.1446 .7056 .7032 .7042 .1384 34 LEU 34 -.1421 .6236 999.9900 999.9900 .9565 .4793 .7068 .7028 .7044 .5695 35 CYS 35 .6740 999.9900 .1296 999.9900 .4013 .4016 .7066 .7036 .7048 .5230 36 ARG 36 1.1353 -2.3766 999.9900 .1593 .8581 -.0129 .7066 .7035 .7048 .1922 37 GLN 37 .0311 -2.6982 999.9900 1.3059 .5113 -.2125 .7062 .7046 .7053 .0935 38 TRP 38 -.4530 -1.6686 999.9900 999.9900 .9378 -.3946 .7066 .7043 .7052 .0454 39 LEU 39 -1.0430 -2.9612 999.9900 999.9900 .8331 -1.0570 .7064 .7019 .7038 -.3525 40 ARG 40 -2.9267 .0684 999.9900 .1593 .8581 -.3363 .7068 .6528 .6753 -.0460 41 PRO 41 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7064 .6119 .6513 .4046 42 GLU 42 -.2127 -1.4588 999.9900 1.1588 .6899 .0443 .7060 .7031 .7043 .2644 43 VAL 43 -2.3613 999.9900 -.0276 999.9900 .7810 -.5360 .7067 .7063 .7065 -.0390 44 ARG 44 -.7709 -.3536 999.9900 .1593 .6728 -.0266 .7066 .7025 .7042 .1823 45 SER 45 -.7998 999.9900 -.0289 999.9900 .6705 -.0527 .7065 .7022 .7040 .2501 46 LYS 46 .2805 .5211 999.9900 .1731 .7460 .3788 .7063 .7030 .7043 .4719 47 GLU 47 .8733 -.8834 999.9900 .3501 .6899 .2575 .7066 .7027 .7043 .4065 48 GLN 48 .7451 -1.4944 999.9900 1.3059 .5113 .2670 .7059 .7035 .7045 .4129 49 MET 49 -.0078 -2.5481 999.9900 .9587 .5203 -.2693 .7066 .7031 .7046 .0554 50 LEU 50 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7065 .7030 .7045 .2204 51 GLU 51 .1185 -1.1891 999.9900 .3501 .6899 -.0077 .7061 .7031 .7043 .2298 52 LEU 52 .8786 -.0645 999.9900 999.9900 .8331 .5490 .7060 .7029 .7042 .6112 53 LEU 53 1.1349 -.6965 999.9900 999.9900 .8331 .4238 .7066 .7034 .7048 .5363 54 VAL 54 .8065 999.9900 -.5532 999.9900 .7810 .3448 .7065 .7060 .7062 .4894 55 LEU 55 .0133 -.3936 999.9900 999.9900 .8331 .1510 .7064 .7034 .7047 .3725 56 GLU 56 .7157 -2.1111 999.9900 -1.0323 .3568 -.5178 .7063 .7036 .7047 -.1102 57 GLN 57 .9013 -2.6982 999.9900 1.3059 .5113 .0051 .7070 .7034 .7049 .2384 58 PHE 58 .7853 .5389 999.9900 999.9900 .7573 .6938 .7061 .7026 .7040 .6980 59 LEU 59 .8475 -.0669 999.9900 999.9900 .8331 .5379 .7061 .7031 .7044 .6046 60 GLY 60 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7063 .7053 .7058 .4466 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7055 .7046 .7050 .4994 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7063 .6571 .6776 -.0291 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7067 .6475 .6722 .3768 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7053 .6101 .6497 .3077 65 GLU 65 -1.3222 -.7281 999.9900 1.7325 .6899 .0930 .7065 .7022 .7040 .2968 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7068 .7062 .7065 .7159 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7069 .7040 .7052 .8197 68 ALA 68 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7070 .7058 .7063 .7636 69 ARG 69 .8354 .0684 999.9900 .1593 .8581 .4161 .7064 .7036 .7047 .4986 70 VAL 70 .8065 999.9900 -1.0788 999.9900 .7810 .1696 .7067 .7058 .7061 .3842 71 GLN 71 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7062 .7039 .7048 .2900 72 GLY 72 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7055 .7051 .7053 .4958 73 GLN 73 -2.2003 -1.7668 999.9900 1.3059 .7898 -.4678 .7067 .7030 .7045 -.0770 74 ARG 74 -1.7561 -2.3766 999.9900 .1593 .8581 -.5912 .7060 .6506 .6737 -.2285 75 PRO 75 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7065 .6081 .6491 .1626 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7067 .7053 .7059 .6253 77 SER 77 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7069 .6541 .6761 .1787 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7062 .6200 .6559 -.1351 79 GLU 79 .8604 .3956 999.9900 -1.0323 .6899 .2284 .7066 .7038 .7050 .3873 80 GLU 80 .8733 -1.0407 999.9900 -1.0323 .6899 -.1275 .7067 .7036 .7049 .1501 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7066 .7054 .7059 .5539 82 ALA 82 .2107 999.9900 999.9900 999.9900 .7881 .4994 .7065 .7054 .7058 .6027 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7065 .7062 .7063 .4309 84 LEU 84 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7062 .7032 .7044 .0199 85 VAL 85 .5660 999.9900 .1416 999.9900 .7810 .4962 .7068 .7063 .7066 .5804 86 ASP 86 1.3227 -2.0928 999.9900 999.9900 .7118 -.0194 .7048 .7036 .7041 .2700 87 GLY 87 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .7065 .7054 .7059 .4038 88 LEU 88 -.5648 .3561 999.9900 999.9900 .9565 .2493 .7068 .7028 .7045 .4315 89 ARG 89 -.1156 .5541 999.9900 .1593 .8581 .3230 .7066 .7026 .7043 .4320 90 ARG 90 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .7061 .7034 .7045 -.4568 91 GLU 91 -.8591 -1.4588 999.9900 -1.0323 .6899 -.6651 .7062 .6538 .6756 -.2167 92 PRO 92 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7043 .6167 .6532 -.3231 93 GLY 93 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .7062 .7058 .7060 -.3215 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7055 .5632 .6445 .6344 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7065 .7055 .7059 .7466 96 SER 302 -2.9368 999.9900 -.7153 999.9900 .6705 -.9939 .7069 .7026 .7044 -.3144 97 ASP 303 -1.0941 -2.3194 999.9900 999.9900 .8104 -.8677 .7062 .6579 .6780 -.2478 98 PRO 304 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7065 .6151 .6532 .4054 99 GLY 305 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7064 .6555 .6782 .4342 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7064 .6045 .6469 .3388 101 GLU 307 .6833 -.8169 999.9900 1.1588 .6899 .4288 .7057 .7023 .7037 .5205 102 ALA 308 .6648 999.9900 999.9900 999.9900 .7458 .7053 .7068 .7054 .7059 .7057 103 ALA 309 .7636 999.9900 999.9900 999.9900 .7458 .7547 .7066 .7056 .7060 .7304 104 ARG 310 .6041 -.3536 999.9900 .1593 .8581 .2855 .7056 .7033 .7042 .4052 105 LEU 311 .9913 -3.3760 999.9900 999.9900 .9565 -.4761 .7055 .7035 .7043 -.0038 106 ARG 312 .6655 .0684 999.9900 .1593 .8581 .3821 .7067 .7034 .7048 .4744 107 PHE 313 .8041 -2.0028 999.9900 999.9900 .8629 -.1119 .7065 .7035 .7048 .2148 108 ARG 314 .6655 -2.8571 999.9900 1.0856 .8581 .1675 .7064 .7025 .7041 .3209 109 CYS 315 -.2798 999.9900 .1296 999.9900 .4013 .0837 .7061 .7031 .7043 .3321 110 PHE 316 -.4296 .8308 999.9900 999.9900 .7573 .3862 .7066 .7040 .7051 .5138 111 HIS 317 -.4783 -2.4183 999.9900 999.9900 .5967 -.7666 .7044 .7042 .7043 -.1783 112 TYR 318 -.1387 -.3119 999.9900 999.9900 .5630 .0374 .7067 .7037 .7050 .3045 113 GLU 319 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7058 .7033 .7044 -.2480 114 GLU 320 .0468 1.1195 999.9900 -1.0323 .6899 .2060 .7067 .7028 .7044 .3722 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7064 .7055 .7059 .6844 116 THR 322 -.2485 999.9900 -.8810 999.9900 .4476 -.2273 .7060 .7057 .7058 .1459 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7069 .6585 .6800 .1561 118 PRO 324 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7068 .6143 .6528 .1642 119 GLN 325 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7069 .7035 .7049 .2560 120 GLU 326 .8171 -1.4588 999.9900 .3501 .6899 .0996 .7062 .7032 .7045 .3013 121 ALA 327 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7065 .7053 .7058 .7454 122 LEU 328 .8182 .1975 999.9900 999.9900 .8331 .6163 .7065 .7033 .7046 .6517 123 ALA 329 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7061 .7047 .7053 .7452 124 GLN 330 .1338 -1.2219 999.9900 1.3059 .5113 .1822 .7064 .7034 .7046 .3565 125 LEU 331 -.1421 -.1732 999.9900 999.9900 .9565 .2137 .7066 .7035 .7048 .4103 126 ARG 332 .6041 -.0419 999.9900 .1593 .6728 .3107 .7061 .7028 .7042 .4232 127 GLU 333 .6833 -.9194 999.9900 .3501 .6899 .2010 .7063 .7019 .7037 .3687 128 LEU 334 .6296 .6236 999.9900 999.9900 .9565 .7366 .7061 .7029 .7042 .7237 129 CYS 335 .6740 999.9900 .1296 999.9900 .4013 .4016 .7067 .7033 .7047 .5230 130 ARG 336 1.1353 -2.3766 999.9900 .1593 .8581 -.0129 .7069 .7020 .7041 .1921 131 GLN 337 .0311 -2.6982 999.9900 1.3059 .5113 -.2125 .7054 .7031 .7041 .0931 132 TRP 338 -.4530 -1.9067 999.9900 999.9900 .9378 -.4739 .7067 .7035 .7048 -.0023 133 LEU 339 -1.0430 -2.9612 999.9900 999.9900 .9565 -1.0159 .7063 .7026 .7041 -.3278 134 ARG 340 -2.9267 .0684 999.9900 .1593 .8581 -.3363 .7060 .6578 .6779 -.0454 135 PRO 341 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7067 .6211 .6568 .4070 136 GLU 342 -.2127 -1.1891 999.9900 1.1588 .6899 .1117 .7068 .7033 .7048 .3095 137 VAL 343 -2.3613 999.9900 -1.0788 999.9900 .7810 -.8863 .7064 .7055 .7059 -.2494 138 ARG 344 -.7709 -.3536 999.9900 .7862 .6728 .2241 .7066 .7024 .7042 .3614 139 SER 345 -.7998 999.9900 -.0289 999.9900 .6705 -.0527 .7067 .7035 .7048 .2504 140 LYS 346 .2805 .5211 999.9900 .1731 .7460 .3788 .7066 .7022 .7041 .4718 141 GLU 347 .8733 -.8834 999.9900 .3501 .6899 .2575 .7069 .7033 .7048 .4067 142 GLN 348 .7451 -1.4944 999.9900 1.3059 .5113 .2670 .7064 .7032 .7045 .4129 143 MET 349 -.0078 -2.5481 999.9900 .9587 .5203 -.2693 .7063 .7031 .7044 .0554 144 LEU 350 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7060 .7035 .7046 .2204 145 GLU 351 .1185 -1.1891 999.9900 .3501 .6899 -.0077 .7062 .7029 .7043 .2298 146 LEU 352 .8786 -.0645 999.9900 999.9900 .8331 .5490 .7065 .7024 .7041 .6112 147 LEU 353 1.1349 -.6965 999.9900 999.9900 .8331 .4238 .7070 .7026 .7044 .5362 148 VAL 354 .8065 999.9900 -.5532 999.9900 .7810 .3448 .7051 .7065 .7059 .4892 149 LEU 355 .0133 -.3936 999.9900 999.9900 .9565 .1921 .7066 .7036 .7049 .3973 150 GLU 356 .7157 -1.9198 999.9900 1.7325 .6899 .3046 .7062 .7026 .7041 .4378 151 GLN 357 .9013 -1.7668 999.9900 1.3059 .5113 .2379 .7067 .7032 .7047 .3936 152 PHE 358 .7853 .5389 999.9900 999.9900 .7573 .6938 .7065 .7024 .7041 .6981 153 LEU 359 .8475 -.0669 999.9900 999.9900 .8331 .5379 .7049 .7024 .7034 .6042 154 GLY 360 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7061 .7057 .7059 .4466 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7056 .7050 .7052 .4995 156 LEU 362 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7064 .6573 .6778 -.0290 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7069 .6410 .6684 .3752 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7066 .6067 .6483 .3072 159 GLU 365 -1.3222 -.7281 999.9900 .3501 .6899 -.2526 .7062 .7025 .7040 .0664 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7070 .7055 .7061 .7158 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7070 .7043 .7054 .8198 162 ALA 368 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7068 .7058 .7063 .7636 163 ARG 369 .8354 .0684 999.9900 1.0005 .8581 .7526 .7064 .7022 .7040 .7388 164 VAL 370 .8065 999.9900 -.0276 999.9900 .7810 .5200 .7069 .7062 .7065 .5946 165 GLN 371 .7451 -2.2325 999.9900 1.3059 .5113 .0824 .7061 .7031 .7044 .2898 166 GLY 372 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7064 .7048 .7055 .4959 167 GLN 373 -2.2003 -1.7668 999.9900 1.3059 .7898 -.4678 .7069 .7036 .7050 -.0768 168 ARG 374 -1.7561 -1.6149 999.9900 .1593 .8581 -.4388 .7066 .6574 .6779 -.1186 169 PRO 375 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7064 .6136 .6523 .1640 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7063 .7053 .7057 .6252 171 SER 377 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7068 .6529 .6754 .1784 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7063 .6152 .6532 -.1363 173 GLU 379 .8604 .3956 999.9900 2.1776 .6899 1.0309 .7058 .7036 .7045 .9221 174 GLU 380 .8733 -1.0407 999.9900 -1.0323 1.0761 -.0309 .7066 .7024 .7041 .2142 175 ALA 381 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7067 .7053 .7059 .5539 176 ALA 382 .2107 999.9900 999.9900 999.9900 .7458 .4783 .7069 .7059 .7063 .5923 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7058 .7058 .7058 .4307 178 LEU 384 .8182 -2.9612 999.9900 999.9900 .8331 -.4366 .7066 .7032 .7046 .0200 179 VAL 385 .5660 999.9900 -.2457 999.9900 .7810 .3671 .7066 .7064 .7064 .5028 180 ASP 386 1.3227 -2.0928 999.9900 999.9900 .8104 .0134 .7059 .7042 .7049 .2901 181 GLY 387 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .7067 .7061 .7063 .4040 182 LEU 388 -.5648 .3561 999.9900 999.9900 .9565 .2493 .7057 .7032 .7043 .4314 183 ARG 389 -.1156 .2472 999.9900 .1593 .8581 .2617 .7065 .7034 .7047 .3883 184 ARG 390 -2.9267 -2.8571 999.9900 .1593 .8581 -.9214 .7054 .7028 .7039 -.4570 185 GLU 391 -.8591 -1.4588 999.9900 1.7325 .6899 .0261 .7064 .6570 .6775 .2447 186 PRO 392 -3.0630 999.9900 999.9900 999.9900 .4496 -1.3067 .7059 .6100 .6500 -.3244 187 GLY 393 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .7055 .7058 .7057 -.3217 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7069 .7043 .7056 .7056 Means: -.1326 -1.0212 -.3793 .4358 .7163 .0454 .7063 .6910 .6974 .2986 2.00 analyzed_17