1 GLY 1 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7068 .7062 .7065 .7469 2 SER 2 -.0420 999.9900 -.0289 999.9900 .6705 .1999 .7058 .7030 .7042 .4017 3 ASP 3 -.3275 -1.8420 999.9900 999.9900 .8104 -.4530 .7062 .6497 .6732 -.0006 4 PRO 4 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7062 .6231 .6577 .4158 5 GLY 5 -.2842 999.9900 999.9900 999.9900 .8277 .2717 .7063 .6536 .6770 .4758 6 PRO 6 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7068 .6066 .6484 .3395 7 GLU 7 1.0761 -1.6501 999.9900 .3501 1.0761 .2130 .7065 .7032 .7046 .3770 8 ALA 8 .9879 999.9900 999.9900 999.9900 .7458 .8668 .7069 .7055 .7061 .7865 9 ALA 9 .3637 999.9900 999.9900 999.9900 .7458 .5548 .7068 .7057 .7061 .6305 10 ARG 10 .6041 .4622 999.9900 .1593 .8581 .4486 .7064 .7031 .7045 .5218 11 LEU 11 .8182 -3.3760 999.9900 999.9900 .9565 -.5337 .7067 .7026 .7043 -.0384 12 ARG 12 .6323 -.8157 999.9900 .5548 .6728 .3198 .7069 .7036 .7050 .4299 13 PHE 13 1.0502 -.9296 999.9900 999.9900 .8629 .3278 .7065 .7032 .7046 .4786 14 ARG 14 -.0126 -.8157 999.9900 .1593 .8581 .0697 .7060 .7026 .7040 .2510 15 CYS 15 .1005 999.9900 .1296 999.9900 .4013 .2105 .7063 .7038 .7048 .4083 16 PHE 16 -.3916 .3244 999.9900 999.9900 .7573 .2300 .7065 .7023 .7041 .4198 17 HIS 17 -.2681 -3.1083 999.9900 999.9900 .5967 -.9266 .7061 .7033 .7045 -.2741 18 TYR 18 -.5013 .2264 999.9900 999.9900 .5630 .0960 .7070 .7040 .7052 .3398 19 GLU 19 -.8041 -1.7714 999.9900 -1.0323 .6899 -.7295 .7061 .7022 .7038 -.2516 20 GLU 20 .0468 -1.6501 999.9900 -1.0323 1.0761 -.3899 .7061 .7027 .7041 -.0251 21 ALA 21 .5799 999.9900 999.9900 999.9900 .8416 .7108 .7068 .7051 .7058 .7084 22 THR 22 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7052 .7064 .7059 .1509 23 GLY 23 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7066 .6592 .6803 .1562 24 PRO 24 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7067 .6078 .6490 .1626 25 GLN 25 1.0064 -2.6982 999.9900 1.3059 .7898 .1010 .7063 .7040 .7050 .3024 26 GLU 26 .8171 -1.7714 999.9900 2.1776 1.0761 .5748 .7061 .7032 .7044 .6181 27 ALA 27 .9879 999.9900 999.9900 999.9900 .7458 .8668 .7070 .7053 .7060 .7865 28 LEU 28 .8182 .5236 999.9900 999.9900 .8331 .7250 .7068 .7031 .7046 .7170 29 ALA 29 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7066 .7050 .7057 .7454 30 GLN 30 .7370 -2.6982 999.9900 1.3059 .5113 -.0360 .7066 .7041 .7051 .2111 31 LEU 31 -.1421 -.1732 999.9900 999.9900 .9565 .2137 .7063 .7027 .7042 .4100 32 ARG 32 .6041 -.0419 999.9900 .1593 .8581 .3478 .7069 .7028 .7045 .4498 33 GLU 33 .6833 -.9194 999.9900 -1.0323 .6899 -.1446 .7069 .7028 .7045 .1385 34 LEU 34 .8442 .6236 999.9900 999.9900 .9565 .8081 .7063 .7030 .7044 .7667 35 CYS 35 1.0802 999.9900 .1296 999.9900 .4013 .5370 .7067 .7035 .7049 .6043 36 ARG 36 1.1353 -2.3766 999.9900 .6901 .8581 .1994 .7067 .7037 .7050 .3439 37 GLN 37 .0311 -1.4944 999.9900 1.3059 .5113 .0885 .7058 .7038 .7046 .2939 38 TRP 38 -.4530 -1.9067 999.9900 999.9900 .9378 -.4739 .7065 .7038 .7049 -.0023 39 LEU 39 -1.0430 -3.3760 999.9900 999.9900 .9565 -1.1541 .7066 .7027 .7044 -.4106 40 ARG 40 -2.9267 -.3536 999.9900 1.4811 .8581 .1080 .7067 .6517 .6746 .2712 41 PRO 41 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7051 .6093 .6492 .4036 42 GLU 42 -.1289 -.6255 999.9900 -1.0323 .6899 -.2742 .7060 .7029 .7042 .0520 43 VAL 43 -2.3613 999.9900 .1416 999.9900 .7810 -.4796 .7066 .7055 .7060 -.0053 44 ARG 44 -.6106 -.1044 999.9900 .1593 .6728 .0553 .7067 .7027 .7044 .2408 45 SER 45 -1.1635 999.9900 -.7153 999.9900 .6705 -.4028 .7069 .7019 .7040 .0401 46 LYS 46 .9451 .5211 999.9900 -.4035 .7460 .2810 .7059 .7021 .7037 .4019 47 GLU 47 .7157 -1.1358 999.9900 -1.0323 .6899 -.1906 .7061 .7026 .7040 .1077 48 GLN 48 1.0064 -.6214 999.9900 1.3059 .5113 .5505 .7062 .7034 .7046 .6020 49 MET 49 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7048 .7037 .7042 .1910 50 LEU 50 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7057 .7030 .7041 .2202 51 GLU 51 .1185 .5701 999.9900 .3501 .6899 .4322 .7049 .7025 .7035 .5227 52 LEU 52 .8786 -.9158 999.9900 999.9900 .9565 .3064 .7044 .7024 .7033 .4652 53 LEU 53 .4996 -.6965 999.9900 999.9900 .8331 .2121 .7062 .7024 .7040 .4090 54 VAL 54 .7683 999.9900 .2799 999.9900 .7810 .6098 .7070 .7063 .7066 .6485 55 LEU 55 .8786 -1.1113 999.9900 999.9900 .9565 .2412 .7068 .7023 .7042 .4266 56 GLU 56 .7157 -.8169 999.9900 -1.0323 .6899 -.1109 .7059 .7024 .7039 .1608 57 GLN 57 .6461 -2.6982 999.9900 1.3059 .5113 -.0587 .7070 .7031 .7047 .1959 58 PHE 58 .7853 .7639 999.9900 999.9900 .7573 .7688 .7058 .7034 .7044 .7432 59 LEU 59 .4996 .5236 999.9900 999.9900 .8331 .6188 .7052 .7036 .7043 .6530 60 GLY 60 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7069 .7050 .7059 .4467 61 ALA 61 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7064 .7056 .7059 .4998 62 LEU 62 -2.6981 .3561 999.9900 999.9900 .8331 -.5030 .7061 .6594 .6788 -.0287 63 PRO 63 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7069 .6361 .6656 .3740 64 PRO 64 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7061 .6155 .6533 .3093 65 GLU 65 -1.3222 -1.2470 999.9900 -1.0323 .6899 -.7279 .7060 .7035 .7046 -.2503 66 ILE 66 .6852 .8778 999.9900 999.9900 .6034 .7221 .7069 .7061 .7064 .7159 67 GLN 67 1.0064 .6315 999.9900 1.3059 .5636 .8769 .7070 .7027 .7045 .8195 68 ALA 68 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7067 .7054 .7060 .7635 69 ARG 69 .6323 -.0184 999.9900 .5548 .8581 .5163 .7064 .7032 .7045 .5702 70 VAL 70 .8065 999.9900 .4980 999.9900 .7810 .6952 .7068 .7060 .7064 .6997 71 GLN 71 .7451 -1.6169 999.9900 1.3059 .5113 .2364 .7063 .7031 .7044 .3925 72 GLY 72 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7066 .7049 .7057 .4960 73 GLN 73 -2.6620 -.7946 999.9900 1.3059 .5113 -.4099 .7065 .7029 .7044 -.0383 74 ARG 74 -2.2658 -2.8571 999.9900 .6901 .8581 -.5769 .7060 .6523 .6746 -.2181 75 PRO 75 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7063 .6240 .6583 -.1341 76 GLY 76 .1996 999.9900 999.9900 999.9900 .8897 .5447 .7066 .7048 .7056 .6252 77 SER 77 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7066 .6533 .6755 .1784 78 PRO 78 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7059 .6135 .6520 -.1369 79 GLU 79 .8604 .3956 999.9900 -1.0323 .6899 .2284 .7061 .7035 .7046 .3872 80 GLU 80 .1885 -1.0407 999.9900 -1.0323 1.0761 -.2021 .7060 .7026 .7040 .1001 81 ALA 81 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7066 .7055 .7060 .5540 82 ALA 82 .3573 999.9900 999.9900 999.9900 .7458 .5516 .7064 .7056 .7059 .6288 83 ALA 83 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7061 .7044 .7051 .4304 84 LEU 84 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7065 .7023 .7041 .0544 85 VAL 85 .5660 999.9900 .1416 999.9900 .8960 .5345 .7066 .7061 .7063 .6033 86 ASP 86 1.1285 -2.8653 999.9900 999.9900 .8104 -.3088 .7066 .7030 .7045 .0966 87 GLY 87 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7063 .7052 .7057 .4466 88 LEU 88 .2140 .6031 999.9900 999.9900 .9565 .5912 .7069 .7029 .7045 .6367 89 ARG 89 -1.6049 -.0184 999.9900 .1593 .6728 -.1264 .7066 .7030 .7045 .1111 90 ARG 90 -1.7561 -.5982 999.9900 1.3917 .8581 .2574 .7061 .7031 .7044 .3852 91 GLU 91 -2.3953 -1.7714 999.9900 -1.0323 .6899 -1.1273 .7064 .6481 .6724 -.5258 92 PRO 92 .4197 999.9900 999.9900 999.9900 .4496 .4347 .7065 .6184 .6551 .5486 93 GLY 93 -.4622 999.9900 999.9900 999.9900 .7883 .1631 .7059 .7052 .7055 .4343 94 GLY 94 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7067 .5603 .6439 .6335 95 GLY 301 999.9900 999.9900 999.9900 999.9900 .8277 .8277 .7068 .7062 .7065 .7469 96 SER 302 -.0420 999.9900 -.0289 999.9900 .6705 .1999 .7060 .7033 .7045 .4018 97 ASP 303 -.3275 -1.8420 999.9900 999.9900 .8104 -.4530 .7066 .6573 .6778 .0009 98 PRO 304 -.1156 999.9900 999.9900 999.9900 .4496 .1670 .7064 .6185 .6551 .4147 99 GLY 305 -.2842 999.9900 999.9900 999.9900 .7883 .2520 .7061 .6505 .6752 .4651 100 PRO 306 -.4052 999.9900 999.9900 999.9900 .4496 .0222 .7070 .6085 .6495 .3400 101 GLU 307 1.0761 -1.6501 999.9900 .3501 1.0761 .2130 .7062 .7027 .7041 .3768 102 ALA 308 .9879 999.9900 999.9900 999.9900 .7881 .8880 .7061 .7057 .7059 .7970 103 ALA 309 .3637 999.9900 999.9900 999.9900 .8416 .6027 .7070 .7045 .7056 .6542 104 ARG 310 .6041 .0684 999.9900 .1593 .8581 .3699 .7068 .7028 .7044 .4655 105 LEU 311 .8182 -3.3760 999.9900 999.9900 .9565 -.5337 .7064 .7030 .7044 -.0384 106 ARG 312 -.1386 -.8157 999.9900 .5548 .8581 .2027 .7068 .7030 .7046 .3462 107 PHE 313 1.0502 -1.8165 999.9900 999.9900 .8629 .0322 .7062 .7035 .7046 .3012 108 ARG 314 .1485 -1.1946 999.9900 .1593 .8581 .0261 .7068 .7035 .7049 .2201 109 CYS 315 .1005 999.9900 .1296 999.9900 .4013 .2105 .7062 .7025 .7040 .4080 110 PHE 316 -.4296 -.4798 999.9900 999.9900 .7573 -.0507 .7066 .7031 .7045 .2515 111 HIS 317 -.2681 -3.1083 999.9900 999.9900 .5967 -.9266 .7059 .7036 .7045 -.2740 112 TYR 318 -.5013 .2264 999.9900 999.9900 .5630 .0960 .7063 .7033 .7045 .3395 113 GLU 319 -1.0962 -1.9198 999.9900 .3501 .6899 -.4940 .7058 .7032 .7043 -.0945 114 GLU 320 -.3243 -2.1111 999.9900 -1.0323 .6899 -.6945 .7056 .7034 .7043 -.2281 115 ALA 321 .5799 999.9900 999.9900 999.9900 .7458 .6629 .7066 .7051 .7057 .6844 116 THR 322 -.2237 999.9900 -.8810 999.9900 .4476 -.2190 .7056 .7061 .7059 .1509 117 GLY 323 -1.5291 999.9900 999.9900 999.9900 .7883 -.3704 .7063 .6576 .6793 .1558 118 PRO 324 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7068 .6170 .6544 .1649 119 GLN 325 1.0064 -2.6982 999.9900 1.3059 .5113 .0314 .7067 .7031 .7046 .2559 120 GLU 326 .8171 -1.5476 999.9900 -1.0323 .6899 -.2682 .7057 .7026 .7039 .0559 121 ALA 327 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7070 .7059 .7063 .7457 122 LEU 328 .8182 .5236 999.9900 999.9900 .8331 .7250 .7059 .7022 .7038 .7166 123 ALA 329 .8241 999.9900 999.9900 999.9900 .7458 .7850 .7068 .7049 .7057 .7454 124 GLN 330 .1338 -1.2219 999.9900 1.3059 .5113 .1822 .7062 .7040 .7049 .3565 125 LEU 331 .6296 -.8871 999.9900 999.9900 .9565 .2330 .7068 .7027 .7044 .4217 126 ARG 332 .6041 -.0419 999.9900 .6901 .8581 .5601 .7068 .7031 .7047 .6015 127 GLU 333 .8171 -1.3104 999.9900 .3501 .6899 .1367 .7063 .7032 .7045 .3260 128 LEU 334 .6509 .9108 999.9900 999.9900 .9565 .8394 .7062 .7025 .7040 .7854 129 CYS 335 .1005 999.9900 .1296 999.9900 .4013 .2105 .7068 .7037 .7050 .4084 130 ARG 336 1.0056 -2.3766 999.9900 1.0856 .8581 .3317 .7064 .7034 .7047 .4383 131 GLN 337 -.0765 -1.3011 999.9900 1.3059 .5113 .1099 .7055 .7033 .7042 .3081 132 TRP 338 -.4530 -1.6686 999.9900 999.9900 .9378 -.3946 .7058 .7038 .7046 .0452 133 LEU 339 -1.0430 -2.9612 999.9900 999.9900 .9565 -1.0159 .7061 .7026 .7041 -.3278 134 ARG 340 -2.9267 -.3536 999.9900 1.4811 .8581 .1080 .7067 .6580 .6783 .2721 135 PRO 341 -.1497 999.9900 999.9900 999.9900 .4496 .1500 .7067 .6114 .6511 .4045 136 GLU 342 -.1289 -.6255 999.9900 -1.0323 .6899 -.2742 .7067 .7031 .7046 .0522 137 VAL 343 -2.3613 999.9900 -.5532 999.9900 .7810 -.7112 .7065 .7062 .7063 -.1441 138 ARG 344 -.6106 -.4762 999.9900 .1593 .6728 -.0191 .7057 .7023 .7037 .1875 139 SER 345 -.7443 999.9900 -.7153 999.9900 .7781 -.2272 .7068 .7017 .7038 .1454 140 LYS 346 .2805 .5211 999.9900 -.0397 .7460 .2936 .7064 .7032 .7045 .4111 141 GLU 347 .8733 -.8834 999.9900 -1.0323 .6899 -.0882 .7062 .7021 .7038 .1760 142 GLN 348 .7451 -.8787 999.9900 1.3059 .5113 .4209 .7067 .7036 .7049 .5156 143 MET 349 .8064 -2.5481 999.9900 .9587 .5203 -.0657 .7067 .7028 .7044 .1911 144 LEU 350 .2355 -1.4996 999.9900 999.9900 .9565 -.1025 .7070 .7031 .7047 .2205 145 GLU 351 .1185 .5701 999.9900 .3501 .6899 .4322 .7064 .7032 .7046 .5230 146 LEU 352 .8786 -.0645 999.9900 999.9900 .8331 .5490 .7061 .7017 .7035 .6110 147 LEU 353 .4996 -1.6462 999.9900 999.9900 .8331 -.1045 .7058 .7026 .7039 .2190 148 VAL 354 .9834 999.9900 .2799 999.9900 .7810 .6814 .7061 .7053 .7056 .6911 149 LEU 355 .0133 -.3936 999.9900 999.9900 .9565 .1921 .7067 .7038 .7050 .3974 150 GLU 356 .1185 -.7009 999.9900 .3501 .6899 .1144 .7067 .7027 .7043 .3111 151 GLN 357 .9013 -2.6982 999.9900 1.3059 .7898 .0747 .7058 .7032 .7043 .2846 152 PHE 358 .7853 -.4306 999.9900 999.9900 .7573 .3707 .7061 .7024 .7040 .5041 153 LEU 359 .8475 .5236 999.9900 999.9900 .8331 .7347 .7056 .7023 .7037 .7224 154 GLY 360 -.4135 999.9900 999.9900 999.9900 .7883 .1874 .7069 .7057 .7062 .4468 155 ALA 361 -.1584 999.9900 999.9900 999.9900 .7458 .2937 .7063 .7053 .7057 .4997 156 LEU 362 -1.6816 .6031 999.9900 999.9900 .8331 -.0818 .7062 .6590 .6787 .2240 157 PRO 363 -.2966 999.9900 999.9900 999.9900 .4496 .0765 .7068 .6437 .6700 .3759 158 PRO 364 -.5342 999.9900 999.9900 999.9900 .4496 -.0423 .7064 .6177 .6547 .3099 159 GLU 365 -1.3222 -1.2470 999.9900 1.1588 .6899 -.1801 .7065 .7031 .7045 .1149 160 ILE 366 .6852 .8778 999.9900 999.9900 .6034 .7221 .7071 .7064 .7067 .7160 161 GLN 367 1.0064 .6315 999.9900 1.3059 .5113 .8638 .7068 .7038 .7050 .8109 162 ALA 368 .8001 999.9900 999.9900 999.9900 .8416 .8209 .7062 .7054 .7058 .7633 163 ARG 369 .6323 -.0184 999.9900 .5548 .8581 .5163 .7060 .7026 .7040 .5700 164 VAL 370 .8065 999.9900 .4980 999.9900 .7810 .6952 .7065 .7064 .7065 .6997 165 GLN 371 .7451 -1.6169 999.9900 1.3059 .5113 .2364 .7064 .7032 .7045 .3925 166 GLY 372 -.2551 999.9900 999.9900 999.9900 .8277 .2863 .7068 .7045 .7055 .4960 167 GLN 373 -2.6620 -.7946 999.9900 1.3059 .7898 -.3402 .7069 .7037 .7050 .0083 168 ARG 374 -2.2658 -2.8571 999.9900 .1593 .8581 -.7892 .7066 .6561 .6772 -.3691 169 PRO 375 -1.1138 999.9900 999.9900 999.9900 .4496 -.3321 .7067 .6166 .6541 .1648 170 GLY 376 .1996 999.9900 999.9900 999.9900 .8277 .5136 .7067 .7049 .7057 .6097 171 SER 377 -.4229 999.9900 -.7153 999.9900 .6705 -.1559 .7064 .6557 .6768 .1789 172 PRO 378 -2.3165 999.9900 999.9900 999.9900 .4496 -.9334 .7061 .6126 .6516 -.1370 173 GLU 379 .8604 .3956 999.9900 -1.0323 .6899 .2284 .7060 .7030 .7042 .3871 174 GLU 380 .1885 -1.0407 999.9900 -1.0323 1.0761 -.2021 .7065 .7030 .7045 .1002 175 ALA 381 .0579 999.9900 999.9900 999.9900 .7458 .4018 .7062 .7059 .7060 .5539 176 ALA 382 .3573 999.9900 999.9900 999.9900 .7458 .5516 .7067 .7060 .7063 .6290 177 ALA 383 -.4347 999.9900 999.9900 999.9900 .7458 .1556 .7062 .7056 .7059 .4307 178 LEU 384 .9913 -2.9612 999.9900 999.9900 .8331 -.3789 .7070 .7034 .7049 .0547 179 VAL 385 .5660 999.9900 -.5532 999.9900 .7810 .2646 .7068 .7063 .7065 .4414 180 ASP 386 1.1285 -2.8653 999.9900 999.9900 .8104 -.3088 .7068 .7044 .7054 .0969 181 GLY 387 -.4135 999.9900 999.9900 999.9900 .8277 .2071 .7048 .7048 .7048 .4559 182 LEU 388 .2140 .6031 999.9900 999.9900 .9565 .5912 .7062 .7034 .7046 .6366 183 ARG 389 -1.6049 -.4122 999.9900 .1593 .6728 -.2051 .7064 .7040 .7050 .0550 184 ARG 390 -1.7561 -.5982 999.9900 1.3917 .8581 .2574 .7069 .7027 .7044 .3852 185 GLU 391 -2.3953 -1.7714 999.9900 -1.0323 .6899 -1.1273 .7064 .6552 .6765 -.5246 186 PRO 392 .4197 999.9900 999.9900 999.9900 .4496 .4347 .7062 .6236 .6580 .5498 187 GLY 393 -.4622 999.9900 999.9900 999.9900 .7883 .1631 .7059 .7052 .7055 .4343 188 GLY 394 999.9900 999.9900 999.9900 999.9900 999.9900 .0000 .7070 .7045 .7057 .7057 Means: -.0371 -1.0016 -.1715 .3868 .7319 .0830 .7064 .6909 .6974 .3216 2.00 analyzed_14