1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7062 .7062 .7062 .7467 2 SER 2 -.4495 999.9900 -.7153 999.9900 .6705 -.1648 .7061 .7031 .7043 .1830 3 ASP 3 -.4109 -1.4116 999.9900 999.9900 .8104 -.3374 .7066 .6579 .6782 .0705 4 PRO 4 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7059 .6208 .6562 .4067 5 GLY 5 -.2842 999.9900 999.9900 999.9900 .7883 .2520 .7068 .6609 .6813 .4680 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7067 .6137 .6525 .3412 7 GLU 7 .6116 1.0351 999.9900 -1.0323 .6899 .3261 .7064 .7029 .7044 .4523 8 ALA 8 .3637 999.9900 999.9900 999.9900 .7881 .5759 .7068 .7054 .7060 .6410 9 ALA 9 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7065 .7058 .7061 .7085 10 ARG 10 .8469 -1.5080 999.9900 .1593 .8581 .1031 .7052 .7032 .7041 .2749 11 LEU 11 .9913 -.1374 999.9900 999.9900 .9565 .6035 .7067 .7034 .7047 .6441 12 ARG 12 .6323 -.8928 999.9900 .1593 .8581 .1833 .7058 .7034 .7044 .3322 13 PHE 13 .4032 -.8310 999.9900 999.9900 .7573 .1098 .7065 .7037 .7048 .3479 14 ARG 14 -.4063 .7395 999.9900 .1593 .8581 .3020 .7063 .7024 .7040 .4169 15 CYS 15 .2727 999.9900 .1296 999.9900 .4013 .2679 .7064 .7029 .7044 .4426 16 PHE 16 -.4296 .5389 999.9900 999.9900 .7573 .2889 .7064 .7030 .7044 .4552 17 HIS 17 -.3815 -2.4183 999.9900 999.9900 .5967 -.7344 .7056 .7037 .7045 -.1588 18 TYR 18 -.1387 -1.2283 999.9900 999.9900 .5630 -.2680 .7069 .7042 .7053 .1214 19 GLU 19 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7060 .7026 .7040 -.2481 20 GLU 20 .0468 -.8169 999.9900 -1.0323 .6899 -.2781 .7060 .7035 .7046 .0495 21 ALA 21 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7067 .7047 .7055 .6843 22 THR 22 -.2485 999.9900 -.2947 999.9900 .4476 -.0319 .7064 .7058 .7061 .2633 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7067 .6623 .6820 .1571 24 PRO 24 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7066 .6122 .6515 .3408 25 GLN 25 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7058 .7036 .7045 .2558 26 GLU 26 .5470 -1.3804 999.9900 .3501 .6899 .0516 .7056 .7034 .7043 .2692 27 ALA 27 .0860 999.9900 999.9900 999.9900 .7458 .4159 .7058 .7056 .7057 .5608 28 LEU 28 .0926 .5655 999.9900 999.9900 .8331 .4971 .7061 .7041 .7050 .5803 29 ALA 29 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7067 .7057 .7061 .6845 30 GLN 30 .1030 -1.7668 999.9900 1.3059 .5113 .0384 .7069 .7036 .7050 .2606 31 LEU 31 .6509 -.2454 999.9900 999.9900 .9565 .4540 .7061 .7027 .7041 .5541 32 ARG 32 1.0056 .7158 999.9900 .9503 .6728 .8590 .7065 .7027 .7043 .8149 33 GLU 33 .6833 -1.9198 999.9900 -1.0323 .6899 -.3947 .7059 .7030 .7042 -.0284 34 LEU 34 .6296 -.0413 999.9900 999.9900 .8331 .4738 .7063 .7031 .7045 .5661 35 CYS 35 1.1812 999.9900 .1296 999.9900 .9108 .7406 .7068 .7042 .7053 .7265 36 ARG 36 .6041 -2.3766 999.9900 .1593 .8581 -.1191 .7064 .7033 .7046 .1163 37 GLN 37 .3572 -2.6982 999.9900 1.3059 .5113 -.1310 .7042 .7027 .7033 .1472 38 TRP 38 -2.2560 -3.3859 999.9900 999.9900 .9378 -1.5680 .7066 .7042 .7052 -.6587 39 LEU 39 .8442 -.9158 999.9900 999.9900 .9565 .2950 .7067 .7029 .7045 .4589 40 ARG 40 -1.9585 -1.2607 999.9900 .1593 .8581 -.4085 .7069 .6538 .6759 -.0974 41 PRO 41 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7054 .6091 .6492 .4036 42 GLU 42 -.1289 -.3719 999.9900 1.1588 .6899 .3370 .7067 .7026 .7043 .4595 43 VAL 43 -1.8566 999.9900 -.5532 999.9900 .7810 -.5429 .7068 .7060 .7064 -.0432 44 ARG 44 -.5614 -.4990 999.9900 .1593 .6728 -.0138 .7069 .7027 .7045 .1915 45 SER 45 -.7443 999.9900 -.7153 999.9900 .6705 -.2630 .7068 .7017 .7038 .1239 46 LYS 46 .7090 -2.9005 999.9900 -.0770 .7460 -.3199 .7065 .7027 .7043 -.0272 47 GLU 47 .8733 -1.3104 999.9900 -1.0323 .6899 -.1949 .7058 .7022 .7037 .1047 48 GLN 48 .6461 .2115 999.9900 1.3059 .5113 .6687 .7061 .7035 .7046 .6807 49 MET 49 .8846 -2.5481 999.9900 .9587 .5203 -.0461 .7065 .7039 .7050 .2043 50 LEU 50 .0926 -2.4128 999.9900 999.9900 .9565 -.4546 .7058 .7025 .7039 .0089 51 GLU 51 .8733 -1.6501 999.9900 -1.0323 .6899 -.2798 .7065 .7029 .7044 .0484 52 LEU 52 1.1349 -1.3019 999.9900 999.9900 .8331 .2220 .7061 .7023 .7039 .4149 53 LEU 53 .8182 -3.3760 999.9900 999.9900 .8331 -.5749 .7061 .7029 .7042 -.0631 54 VAL 54 .1911 999.9900 .6672 999.9900 .7810 .5464 .7052 .7060 .7057 .6101 55 LEU 55 .9913 -2.9612 999.9900 999.9900 .9565 -.3378 .7062 .7035 .7047 .0793 56 GLU 56 .7157 -1.4588 999.9900 -1.0323 .6899 -.2714 .7060 .7034 .7045 .0540 57 GLN 57 .9013 -2.6982 999.9900 1.3059 .7898 .0747 .7061 .7039 .7048 .2848 58 PHE 58 .7853 .5389 999.9900 999.9900 .7573 .6938 .7063 .7021 .7039 .6980 59 LEU 59 .4996 .5402 999.9900 999.9900 .8331 .6243 .7067 .7030 .7046 .6565 60 GLY 60 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7068 .7052 .7059 .6124 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7066 .7047 .7055 .4997 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7066 .6577 .6781 -.0289 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7061 .6400 .6676 .3748 64 PRO 64 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7067 .6158 .6537 .4056 65 GLU 65 -1.3222 -1.2470 999.9900 -1.0323 .6899 -.7279 .7067 .7037 .7049 -.2502 66 ILE 66 .5785 .8778 999.9900 999.9900 .6034 .6866 .7068 .7057 .7061 .6944 67 GLN 67 .7451 .6315 999.9900 1.3059 .5636 .8115 .7067 .7035 .7049 .7760 68 ALA 68 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7068 .7054 .7060 .6736 69 ARG 69 .6323 -.7463 999.9900 .6901 .8581 .4249 .7057 .7030 .7041 .5047 70 VAL 70 .1911 999.9900 -1.0788 999.9900 .7810 -.0355 .7063 .7057 .7059 .2611 71 GLN 71 .9732 -1.9601 999.9900 1.3059 .5113 .2076 .7060 .7029 .7042 .3732 72 GLY 72 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7063 .7042 .7051 .5381 73 GLN 73 -3.1236 -.9251 999.9900 1.3059 .5113 -.5579 .7065 .7026 .7042 -.1371 74 ARG 74 -2.2658 -2.8571 999.9900 .1593 .8581 -.7892 .7059 .6518 .6743 -.3698 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7053 .6231 .6574 -.1346 76 GLY 76 .9055 999.9900 999.9900 999.9900 .8277 .8666 .7067 .7047 .7056 .7862 77 SER 77 -.0851 999.9900 -.7153 999.9900 .6705 -.0433 .7066 .6475 .6721 .2448 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7070 .6095 .6501 -.1376 79 GLU 79 1.0761 .3748 999.9900 -1.0323 .3568 .1938 .7058 .7039 .7047 .3642 80 GLU 80 .1885 -.4224 999.9900 -1.0323 .6899 -.1441 .7052 .7028 .7038 .1386 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7067 .7058 .7061 .5540 82 ALA 82 .3573 999.9900 999.9900 999.9900 .7458 .5516 .7069 .7057 .7062 .6289 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7063 .7047 .7053 .4305 84 LEU 84 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7063 .7034 .7046 .0546 85 VAL 85 .5660 999.9900 -1.0788 999.9900 .7810 .0894 .7060 .7056 .7058 .3360 86 ASP 86 1.3227 -1.9171 999.9900 999.9900 .8104 .0720 .7065 .7044 .7053 .3254 87 GLY 87 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .7067 .7059 .7062 .4040 88 LEU 88 -.2410 -.6965 999.9900 999.9900 .9565 .0063 .7059 .7024 .7039 .2855 89 ARG 89 -.1156 -.7801 999.9900 .6901 .8581 .2685 .7061 .7026 .7041 .3930 90 ARG 90 -.5614 .4564 999.9900 .1593 .8581 .2143 .7063 .7022 .7039 .3543 91 GLU 91 -2.8104 -.7859 999.9900 .3501 .6899 -.6391 .7067 .6536 .6757 -.1993 92 PRO 92 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7062 .6209 .6564 .1657 93 GLY 93 -3.4864 999.9900 999.9900 999.9900 .8277 -1.3294 .7057 .7049 .7053 -.3120 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7064 .5578 .6427 .6321 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7062 .7061 .7062 .7467 96 SER 302 -.4495 999.9900 -.7153 999.9900 .6705 -.1648 .7068 .7024 .7042 .1830 97 ASP 303 -.4109 -1.4116 999.9900 999.9900 .8104 -.3374 .7068 .6564 .6774 .0702 98 PRO 304 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7051 .6208 .6559 .4064 99 GLY 305 -.2842 999.9900 999.9900 999.9900 .7883 .2520 .7064 .6571 .6790 .4669 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7062 .6035 .6463 .3386 101 GLU 307 .6116 1.0351 999.9900 -1.0323 .6899 .3261 .7065 .7021 .7039 .4521 102 ALA 308 .3637 999.9900 999.9900 999.9900 .7881 .5759 .7068 .7053 .7059 .6410 103 ALA 309 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7065 .7053 .7058 .6844 104 ARG 310 .8469 -1.5080 999.9900 .6901 .8581 .3154 .7064 .7031 .7045 .4267 105 LEU 311 .6296 -1.0593 999.9900 999.9900 .9565 .1756 .7066 .7037 .7049 .3874 106 ARG 312 .6323 -.3726 999.9900 .1593 .6728 .2502 .7069 .7032 .7047 .3802 107 PHE 313 .4032 -.1636 999.9900 999.9900 .8629 .3675 .7061 .7031 .7043 .5023 108 ARG 314 -.4063 .7395 999.9900 .1593 .8581 .3020 .7062 .7028 .7042 .4170 109 CYS 315 .3033 999.9900 .1296 999.9900 .4013 .2781 .7060 .7033 .7045 .4487 110 PHE 316 -1.4107 -.6308 999.9900 999.9900 .7573 -.4281 .7056 .7021 .7036 .0247 111 HIS 317 -.1228 -2.4183 999.9900 999.9900 .5967 -.6481 .7059 .7027 .7040 -.1072 112 TYR 318 -.1387 -1.2283 999.9900 999.9900 .5630 -.2680 .7070 .7037 .7051 .1213 113 GLU 319 -1.0962 -1.4588 999.9900 -1.0323 .6899 -.7243 .7060 .7033 .7045 -.2480 114 GLU 320 .0468 -.8169 999.9900 -1.0323 1.0761 -.1816 .7064 .7030 .7044 .1139 115 ALA 321 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7055 .7049 .7052 .7080 116 THR 322 -.2485 999.9900 -.8810 999.9900 .4476 -.2273 .7065 .7067 .7066 .1463 117 GLY 323 -2.6716 999.9900 999.9900 999.9900 .7883 -.9416 .7061 .6592 .6800 -.1295 118 PRO 324 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7062 .6079 .6489 .3396 119 GLN 325 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7065 .7026 .7042 .2558 120 GLU 326 .5470 -1.4588 999.9900 .3501 .6899 .0321 .7064 .7028 .7043 .2562 121 ALA 327 .0860 999.9900 999.9900 999.9900 .7458 .4159 .7060 .7051 .7055 .5607 122 LEU 328 .0926 .5655 999.9900 999.9900 .8331 .4971 .7065 .7028 .7043 .5801 123 ALA 329 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7062 .7054 .7057 .6843 124 GLN 330 .1030 -2.6982 999.9900 1.3059 .5113 -.1945 .7063 .7025 .7041 .1051 125 LEU 331 .6509 -.2454 999.9900 999.9900 .9565 .4540 .7060 .7035 .7046 .5543 126 ARG 332 1.0056 .7158 999.9900 .1593 .8581 .5796 .7065 .7024 .7041 .6153 127 GLU 333 .6833 -1.9198 999.9900 1.7325 .6899 .2965 .7065 .7023 .7041 .4325 128 LEU 334 .9913 -.0413 999.9900 999.9900 .9565 .6355 .7055 .7031 .7041 .6630 129 CYS 335 1.1812 999.9900 .1296 999.9900 .4013 .5707 .7067 .7036 .7049 .6245 130 ARG 336 .6041 -2.3766 999.9900 .6901 .8581 .0932 .7056 .7036 .7044 .2679 131 GLN 337 .3572 -2.6982 999.9900 1.3059 .5113 -.1310 .7069 .7036 .7049 .1478 132 TRP 338 -2.2560 -3.3859 999.9900 999.9900 .9378 -1.5680 .7063 .7035 .7047 -.6588 133 LEU 339 1.1349 -.0234 999.9900 999.9900 .9565 .6893 .7058 .7020 .7036 .6951 134 ARG 340 -1.9585 -1.2607 999.9900 .1593 .8581 -.4085 .7070 .6485 .6729 -.0981 135 PRO 341 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7069 .6076 .6490 .4036 136 GLU 342 .0765 -.3719 999.9900 .3501 .6899 .1862 .7066 .7029 .7044 .3590 137 VAL 343 -1.8566 999.9900 -.2457 999.9900 .7810 -.4404 .7068 .7063 .7065 .0184 138 ARG 344 -.4840 -.4990 999.9900 .5548 .6728 .1599 .7067 .7028 .7044 .3155 139 SER 345 -.7998 999.9900 -.7153 999.9900 .6705 -.2816 .7068 .7018 .7039 .1128 140 LYS 346 -.1232 -2.9005 999.9900 -.0770 .7460 -.4863 .7068 .7030 .7046 -.1460 141 GLU 347 1.0761 -1.3104 999.9900 -1.0323 .6899 -.1442 .7066 .7038 .7050 .1389 142 GLN 348 .7370 .2115 999.9900 1.3059 .5113 .6914 .7065 .7032 .7046 .6959 143 MET 349 1.1168 -1.7864 999.9900 .9587 .5203 .2023 .7065 .7036 .7048 .3699 144 LEU 350 .8182 -2.0611 999.9900 999.9900 .9565 -.0954 .7054 .7040 .7046 .2246 145 GLU 351 .7157 -1.6501 999.9900 -1.0323 .6899 -.3192 .7065 .7017 .7037 .0219 146 LEU 352 .8182 -1.3019 999.9900 999.9900 .8331 .1165 .7064 .7032 .7045 .3518 147 LEU 353 .8182 -3.3760 999.9900 999.9900 .8331 -.5749 .7063 .7024 .7040 -.0632 148 VAL 354 .1911 999.9900 .3968 999.9900 .7810 .4563 .7055 .7061 .7058 .5561 149 LEU 355 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7062 .7022 .7039 .0543 150 GLU 356 .7157 -1.4588 999.9900 -1.0323 .3568 -.3547 .7069 .7036 .7050 -.0013 151 GLN 357 .9013 -2.2325 999.9900 1.3059 .5113 .1215 .7069 .7037 .7051 .3161 152 PHE 358 .7853 .5389 999.9900 999.9900 .7573 .6938 .7069 .7023 .7042 .6981 153 LEU 359 .4996 .5402 999.9900 999.9900 .8331 .6243 .7066 .7026 .7042 .6564 154 GLY 360 .2494 999.9900 999.9900 999.9900 .7883 .5188 .7065 .7051 .7057 .6123 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7039 .7054 .7048 .4992 156 LEU 362 -1.6816 .3561 999.9900 999.9900 .8331 -.1641 .7060 .6489 .6727 .1725 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7067 .6427 .6694 .3756 158 PRO 364 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7062 .6136 .6522 .4049 159 GLU 365 -1.3222 -1.2470 999.9900 -1.0323 .6899 -.7279 .7063 .7032 .7045 -.2503 160 ILE 366 .5785 .8778 999.9900 999.9900 .6034 .6866 .7054 .7065 .7060 .6943 161 GLN 367 .7451 .6315 999.9900 1.3059 .5636 .8115 .7063 .7026 .7041 .7758 162 ALA 368 .5364 999.9900 999.9900 999.9900 .7458 .6411 .7065 .7053 .7058 .6735 163 ARG 369 .6323 -.7463 999.9900 .6901 .8581 .4249 .7069 .7026 .7044 .5048 164 VAL 370 .1911 999.9900 -1.0788 999.9900 .7810 -.0355 .7069 .7064 .7066 .2613 165 GLN 371 .9732 -1.9601 999.9900 3.6599 .5113 .7961 .7058 .7040 .7047 .7657 166 GLY 372 -.0858 999.9900 999.9900 999.9900 .8277 .3709 .7068 .7040 .7052 .5381 167 GLN 373 -3.1236 -.9251 999.9900 1.3059 .5113 -.5579 .7064 .7039 .7049 -.1369 168 ARG 374 -2.2658 -2.8571 999.9900 .1593 .8581 -.7892 .7067 .6522 .6749 -.3696 169 PRO 375 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7057 .6161 .6535 -.1362 170 GLY 376 .9055 999.9900 999.9900 999.9900 .8897 .8976 .7065 .7054 .7059 .8018 171 SER 377 -.0851 999.9900 -.7153 999.9900 .6705 -.0433 .7062 .6485 .6726 .2450 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7055 .6057 .6473 -.1389 173 GLU 379 1.0761 .3748 999.9900 -1.0323 .6899 .2771 .7058 .7025 .7038 .4195 174 GLU 380 .1885 -.4224 999.9900 .3501 1.0761 .2981 .7067 .7031 .7046 .4337 175 ALA 381 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7068 .7052 .7059 .5539 176 ALA 382 .3573 999.9900 999.9900 999.9900 .7881 .5727 .7064 .7057 .7060 .6394 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7062 .7055 .7058 .4307 178 LEU 384 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7059 .7031 .7043 .0545 179 VAL 385 .5660 999.9900 -1.0788 999.9900 .7810 .0894 .7054 .7059 .7057 .3359 180 ASP 386 1.3227 -1.9171 999.9900 999.9900 .8104 .0720 .7065 .7037 .7048 .3252 181 GLY 387 -.5849 999.9900 999.9900 999.9900 .7883 .1017 .7056 .7045 .7050 .4033 182 LEU 388 -.2410 -.6965 999.9900 999.9900 .9565 .0063 .7063 .7026 .7041 .2856 183 ARG 389 -.1156 -.7801 999.9900 .6901 .8581 .2685 .7065 .7029 .7044 .3931 184 ARG 390 -.5614 .4564 999.9900 .6901 .8581 .4266 .7059 .7032 .7043 .5060 185 GLU 391 -2.8104 -.7859 999.9900 .3501 .6899 -.6391 .7065 .6560 .6770 -.1990 186 PRO 392 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7061 .6114 .6509 .1634 187 GLY 393 -3.4864 999.9900 999.9900 999.9900 .7883 -1.3491 .7066 .7056 .7061 -.3215 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7060 .7034 .7047 .7047 Means: -.0559 -1.0771 -.4500 .3052 .7165 .0361 .7063 .6907 .6972 .2928 2.00 analyzed_12