*HEADER BIOSYNTHETIC PROTEIN 03-FEB-10 SMS20121 *TITLE TUBULYSIN CONFORMATION BOUND TO TUBULIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: TUBULYSIN A; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: ANGIOCOCCUS DISCIFORMIS; *SOURCE 3 ORGANISM_TAXID: 38; *SOURCE 4 EXPRESSION_SYSTEM: ANGIOCOCCUS DISCIFORMIS; *SOURCE 5 EXPRESSION_SYSTEM_TAXID: 38 *KEYWDS TUBULYSIN, CONFORMATIONAL ANALYSIS, MICROTUBULES, INTERLIGAND NOES, *KEYWDS 2 BIOSYNTHETIC PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR K.KUBICEK, S.K.GRIMM, J.ORTS, F.SASSE, T.CARLOMAGNO !NOE intensities at mixing times 40, 70, 100, 150 ms assign (name H111) (name H241) 337 631 923 1017.5 assign (name H111) (name H232) 485 835 1100 1340 assign (name H111) (name H191) 144 117 255 297 assign (name H111) (name H291) 2693 3543 3565 3004.5 assign (name H111) (name H292) 3816.5 4055 3294 1530 assign (name H121) (name H241) 356 325 663 732 assign (name H121) (name H291) 294 551 651 757 assign (name H141) (name H142) 13300 13450 13100 10415 assign (name H141) (name H131) 2200 3245 3955 4320 assign (name H151) (name H131) 8380 11215 12550 14050 assign (name H151) (name H491) 195 504 687.5 991 assign (name H151) (name H501) 145.5 390.5 732.5 1109.5 assign (name H151) (name H331) 880 1350 1840 2340 assign (name H151) (name H401) 110 196.5 304 479 assign (name H151) (name H241) 423.5 817.5 1125 1430 assign (name H151) (name H232) 368 699 1200 1780 assign (name H151) (name H191) 91 239 336 473 assign (name H151) (name H291) 259.5 400.5 688 875.5 assign (name H151) (name H292) 566 806 1100 1330 assign (name H131) (name H451) 90 243 257 417 assign (name H131) (name H461) 23 279 255 415 assign (name H131) (name H491) 182.5 561 797 1137 assign (name H131) (name H501) 187.5 572.5 802.5 1165 assign (name H131) (name H331) 1549 2298 3028 3436 assign (name H131) (name H241) 3634 5155.5 5588.5 5571.5 assign (name H131) (name H232) 753 1309 1951 2480 assign (name H131) (name H191) 576 951 1180 1570 assign (name H131) (name H291) 619 1070.5 1361 1710 assign (name H131) (name H292) 619.5 983 1284.5 1562 assign (name H31) (name H41) 2700 3880 4170 4180 assign (name H32) (name H61) 445 748 872 976 assign (name H32) (name H62) 58 158 254 447 assign (name H32) (name H71) 159 564 669 1140 assign (name H41) (name H21) 651 1350 1870 2200 assign (name H41) (name H42) 12700 14500 13700 11400 assign (name H41) (name H61) 2720 3650 4250 4270 assign (name H41) (name H62) 1500 2400 2790 3100 assign (name H41) (name H71) 1133.5 2150 2875 3600 assign (name H42) (name H21) 687 1100 1080 1190 assign (name H42) (name H31) 1615 2315 2445 2425 assign (name H42) (name H61) 270 526 633 861 assign (name H42) (name H62) 73 229 304 322 assign (name H42) (name H71) 103.5 380 588.5 961 assign (name H61) (name H21) 405 481 629 705 assign (name H61) (name H62) 3420 3590 3550 2640 assign (name H61) (name H71) 1740 2575 3075 3205 assign (name H71) (name H151) 115 231 290 442 assign (name H71) (name H21) 996 1680 1840 2100 assign (name H71) (name H62) 1552 2312 2557 2662 assign (name H351) (name H131) 2040 3510 4810 6310 assign (name H551) (name H461) 742 1050 1670 1930 assign (name H541) (name H542) 11100 14400 13750 10380 assign (name H541) (name H461) 1215 1735 2035 2255 assign (name H541) (name H462) 1035 1735 1940 2225 assign (name H541) (name H491) 1129.5 1695 2100 2535 assign (name H541) (name H501) 201 408 675.5 880 assign (name H542) (name H461) 1318 2083 2400.5 2491 assign (name H542) (name H462) 1480 2158 2271 2294.5 assign (name H542) (name H491) 1366.5 2125 2625 3195 assign (name H542) (name H501) 353 621 934 1304.5 assign (name H451) (name H461) 3767.5 4497.5 5344.5 5102.5 assign (name H451) (name H462) 2400.5 4273 4510 3770 assign (name H451) (name H491) 2365 3587 4275 4615.5 assign (name H451) (name H501) 669.5 994.5 1385 1850 assign (name H451) (name H401) 243.5 349 406.5 457 assign (name H461) (name H462) 19000 17750 16250 12650 assign (name H462) (name H551) 768 1275 1375 1690 assign (name H462) (name H501) 414 594 876 1320 assign (name H561) (name H111) 91 47 201 357 assign (name H561) (name H151) 540 1160 1350 1610 assign (name H561) (name H131) 885 1130 1510 1870 assign (name H561) (name H551) 5113.5 6656 8500.5 9485 assign (name H561) (name H541) 3065 4555 5345 5925 assign (name H561) (name H542) 3320 5190 6450 7420 assign (name H561) (name H451) 2265 3260 4085 4760 assign (name H561) (name H461) 754.5 1340 1755 2370 assign (name H561) (name H462) 749 1326.5 1805 2325 assign (name H561) (name H491) 945 1590 2080 3000 assign (name H561) (name H501) 438 691 1160 1600 assign (name H561) (name H331) 144 452 632 1010 assign (name H561) (name H401) 186 349 465 820 assign (name H561) (name H241) 46 108 196 262 assign (name H561) (name H232) 53 246 506 729 assign (name H561) (name H191) 71 180 199 383 assign (name H491) (name H111) 89 116.5 208.5 302.5 assign (name H491) (name H551) 661 1062.5 1525 1975 assign (name H491) (name H461) 3235.5 4232 4959 5202.5 assign (name H491) (name H462) 3007.5 4229.5 4792 4863.5 assign (name H491) (name H401) 350.5 591 768.5 952 assign (name H491) (name H341) 99 363 589 857 assign (name H491) (name H232) 374 684 990 1200 assign (name H491) (name H191) 208 185 289 299 assign (name H491) (name H291) 119.5 256 297.5 379 assign (name H491) (name H292) 97 41 201 244 assign (name H501) (name H111) 44 139 236 335 assign (name H501) (name H551) 118 272.5 431 694.5 assign (name H501) (name H461) 553 1041 1490 1975 assign (name H501) (name H491) 18400 23450 28400 31800 assign (name H501) (name H401) 234.5 380 535 768.5 assign (name H501) (name H232) 725 1290 1790 2410 assign (name H501) (name H191) 255 224 454 586 assign (name H501) (name H291) 257 530 615 698 assign (name H501) (name H292) 17 188 364 397 assign (name H271) (name H111) 232 483 687 932 assign (name H271) (name H141) 139 325 534 678 assign (name H271) (name H142) 221 373 673 971 assign (name H271) (name H151) 594 1190 1930 2640 assign (name H271) (name H131) 1410 2330 3150 4020 assign (name H271) (name H491) 339 613 956 1320 assign (name H271) (name H501) 376 811 1140 1500 assign (name H271) (name H401) 163 389 602 749 assign (name H271) (name H241) 1050 1710 1950 2290 assign (name H271) (name H191) 1190 1780 2230 2580 assign (name H271) (name H291) 529 614 803 733 assign (name H271) (name H292) 284 386 531 739 assign (name H331) (name H491) 131 258 386.5 550.5 assign (name H331) (name H501) 133 222.5 377.5 540.5 assign (name H331) (name H241) 462 696 845 944 assign (name H332) (name H491) 0 113 168 253 assign (name H332) (name H501) 59 50 90 164 assign (name H332) (name H241) 200 336 416 424 assign (name H401) (name H111) 51 107 183 200 assign (name H401) (name H131) 80 263 452 593 assign (name H401) (name H551) 130 114 191.5 250 assign (name H401) (name H461) 109 206 285 403 assign (name H401) (name H232) 179 207 320 442 assign (name H401) (name H191) 84 217 214 315 assign (name H401) (name H291) 124 165 210 172 assign (name H401) (name H292) 395 641 734 994 assign (name H241) (name H141) 215 318 374 565 assign (name H241) (name H142) 232 511 585 785 assign (name H241) (name H491) 151.5 269 282.5 416 assign (name H241) (name H501) 172 341 366.5 527.5 assign (name H241) (name H401) 127.5 305.5 329.5 362.5 assign (name H241) (name H232) 2135 2920 3420 3490 assign (name H241) (name H191) 2134 2976 2832 2810 assign (name H241) (name H292) 618 884 1170 1270 assign (name H201) (name H111) 337.5 604 815.5 954 assign (name H201) (name H501) 30 76 122 144 assign (name H201) (name H241) 360.5 692.5 822.5 1011 assign (name H201) (name H291) 2483.5 2669 2330 1400 assign (name H201) (name H292) 518.5 663 866 843.5 assign (name H291) (name H241) 609.5 962.5 1243 1357.5 assign (name H291) (name H232) 1110.5 1565 1825 1900 assign (name H291) (name H191) 286 436 411 579 assign (name H292) (name H232) 197 179 371 418 assign (name H361) (name H111) 450 697 919 1090 assign (name H361) (name H141) 30 62 353 560 assign (name H361) (name H151) 510 1370 1750 2540 assign (name H361) (name H131) 873 1580 3000 3850 assign (name H361) (name H551) 299 607 798 1050 assign (name H361) (name H451) 262 414 570 814 assign (name H361) (name H461) 200 464 556 961 assign (name H361) (name H462) 191 402 547 759 assign (name H361) (name H561) 1040 1500 2730 3330 assign (name H361) (name H491) 352 647 1020 1480 assign (name H361) (name H501) 331 633 1010 1400 assign (name H361) (name H331) 1010 1690 2200 2870 assign (name H361) (name H332) 1090 1900 2570 3160 assign (name H361) (name H401) 336 651 649 916 assign (name H361) (name H241) 302 532 786 1040 assign (name H361) (name H232) 679 1170 1540 2050 assign (name H361) (name H191) 206 416 520 603 assign (name H361) (name H291) 188 363 464 645 assign (name H361) (name H292) 303 300 509 753 assign (name H361) (name H221) 383 795 1810 2150 assign (name H351) (name H151) 2040 3200 4200 5210 assign (name H351) (name H111) 1620 2410 3310 3930 assign (name H351) (name H141) 22 541 707 1160 assign (name H351) (name H142) 153 701 1260 2030 assign (name H351) (name H61) 173 251 391 497 assign (name H351) (name H551) 318 742 946 1380 assign (name H351) (name H451) 298 590 942 1370 assign (name H351) (name H461) 407 752 1140 1690 assign (name H351) (name H491) 564 989 1590 2040 assign (name H351) (name H501) 617 1120 1550 2110 assign (name H351) (name H401) 309 498 757 986 assign (name H351) (name H241) 999 1740 2300 3000 assign (name H351) (name H191) 2932 3976 4769 4966 assign (name H351) (name H291) 2327 3463 3974 4438 assign (name H351) (name H292) 1730 2489 3223 3426 assign (name H351) (name H221) 8010 11733 13912 15858 assign (name H221) (name H111) 456 890 1167.5 1600 assign (name H221) (name H151) 639 1058 1274.5 1710 assign (name H221) (name H131) 3390 3595 3570 3860 assign (name H221) (name H451) 138 307 459 589 assign (name H221) (name H491) 351 647 911 1220 assign (name H221) (name H501) 647 1090 1400 1850 assign (name H221) (name H271) 2690 4320 5460 6615 assign (name H221) (name H401) 168 268 374 529 assign (name H221) (name H241) 1385 2370 2965 3785 assign (name H221) (name H232) 6454 8624 9110 8620 assign (name H221) (name H191) 4493 6227 7023 7140 assign (name H221) (name H201) 1360 2715 2655 2935 Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H52 UVR 1 H52 UVR 1 9.606 2.765 -3.144 2 H51 UVR 1 H51 UVR 1 9.615 1.792 -1.669 3 H42 UVR 1 H42 UVR 1 9.778 0.455 -3.826 4 H31 UVR 1 H31 UVR 1 10.534 -0.759 -1.962 5 H62 UVR 1 H62 UVR 1 11.212 3.454 -1.180 6 H41 UVR 1 H41 UVR 1 11.376 1.228 -4.071 7 H61 UVR 1 H61 UVR 1 11.793 3.507 -2.841 8 H32 UVR 1 H32 UVR 1 11.950 -0.788 -2.996 9 H21 UVR 1 H21 UVR 1 12.974 -0.070 -1.025 10 H73 UVR 1 H73 UVR 1 13.134 2.402 0.298 11 H71 UVR 1 H71 UVR 1 13.593 3.604 -0.907 12 H72 UVR 1 H72 UVR 1 14.494 2.094 -0.786 13 H ILE 2 H ILE 2 10.688 -1.266 -0.104 14 HA ILE 2 H111 ILE 2 8.723 0.766 0.555 15 HB ILE 2 H121 ILE 2 8.216 -2.154 0.967 16 HG12 ILE 2 H142 ILE 2 8.643 -0.914 -1.779 17 HG13 ILE 2 H141 ILE 2 9.546 -2.259 -1.086 18 HG21 ILE 2 H132 ILE 2 6.050 -1.635 -0.059 19 HG22 ILE 2 H131 ILE 2 6.387 -0.413 1.168 20 HG23 ILE 2 H133 ILE 2 6.622 -0.047 -0.532 21 HD11 ILE 2 H153 ILE 2 7.353 -3.555 -0.939 22 HD12 ILE 2 H151 ILE 2 7.810 -3.171 -2.606 23 HD13 ILE 2 H152 ILE 2 6.565 -2.220 -1.781 24 H401 UVR 3 H401 UVR 3 1.383 -3.910 2.430 25 H361 UVR 3 H361 UVR 3 3.842 3.341 -1.125 26 H272 UVR 3 H272 UVR 3 4.029 -3.050 6.208 27 H271 UVR 3 H271 UVR 3 4.140 -1.732 5.044 28 H352 UVR 3 H352 UVR 3 4.496 1.292 -2.329 29 H273 UVR 3 H273 UVR 3 4.604 -1.467 6.726 30 H363 UVR 3 H363 UVR 3 4.656 2.126 -0.138 31 H351 UVR 3 H351 UVR 3 5.042 2.282 -3.684 32 H362 UVR 3 H362 UVR 3 5.103 3.827 0.007 33 H231 UVR 3 H231 UVR 3 5.296 -0.463 4.276 34 H223 UVR 3 H223 UVR 3 5.653 1.397 4.520 35 H232 UVR 3 H232 UVR 3 5.780 -0.056 2.678 36 H222 UVR 3 H222 UVR 3 5.860 1.692 6.243 37 H341 UVR 3 H341 UVR 3 5.951 3.807 -2.320 38 H353 UVR 3 H353 UVR 3 6.130 1.098 -2.967 39 H241 UVR 3 H241 UVR 3 6.598 -2.339 2.312 40 H221 UVR 3 H221 UVR 3 6.867 2.544 5.072 41 H292 UVR 3 H292 UVR 3 6.897 1.994 3.126 42 H201 UVR 3 H201 UVR 3 7.106 -0.205 6.146 43 H332 UVR 3 H332 UVR 3 7.413 1.408 -1.438 44 H191 UVR 3 H191 UVR 3 7.925 -1.273 4.259 45 H331 UVR 3 H331 UVR 3 8.007 3.024 -1.693 46 H291 UVR 3 H291 UVR 3 8.420 2.369 2.454 47 H212 UVR 3 H212 UVR 3 8.749 1.907 6.292 48 H211 UVR 3 H211 UVR 3 9.363 0.257 6.266 49 H213 UVR 3 H213 UVR 3 9.365 1.216 4.788 50 H511 UVR 4 H511 UVR 4 0.436 4.595 1.720 51 H451 UVR 4 H451 UVR 4 0.477 -0.876 -1.808 52 H551 UVR 4 H551 UVR 4 1.090 0.197 -3.993 53 H542 UVR 4 H542 UVR 4 1.214 1.741 -2.067 54 H491 UVR 4 H491 UVR 4 2.049 -0.070 1.590 55 H563 UVR 4 H563 UVR 4 2.199 -1.787 -3.827 56 H541 UVR 4 H541 UVR 4 2.747 1.046 -1.565 57 HAB UVR 4 HAB UVR 4 2.963 -0.611 -0.388 58 H501 UVR 4 H501 UVR 4 2.975 1.420 3.138 59 HAD UVR 4 HAD UVR 4 2.996 3.454 -4.383 60 HAA UVR 4 HAA UVR 4 3.006 3.579 4.008 61 H561 UVR 4 H561 UVR 4 3.138 -1.205 -2.445 62 H562 UVR 4 H562 UVR 4 3.691 -0.889 -4.090 63 H462 UVR 4 H462 UVR 4 -0.327 -0.370 0.435 64 H481 UVR 4 H481 UVR 4 -0.546 3.091 0.113 65 H461 UVR 4 H461 UVR 4 -0.710 0.886 -0.721 Start of MODEL 2 1 H52 UVR 1 H52 UVR 1 9.418 2.570 -3.041 2 H42 UVR 1 H42 UVR 1 9.543 0.203 -3.570 3 H51 UVR 1 H51 UVR 1 9.613 1.683 -1.530 4 H31 UVR 1 H31 UVR 1 10.658 -0.974 -1.914 5 H41 UVR 1 H41 UVR 1 11.039 1.014 -4.125 6 H62 UVR 1 H62 UVR 1 11.206 3.436 -1.355 7 H61 UVR 1 H61 UVR 1 11.642 3.314 -3.057 8 H32 UVR 1 H32 UVR 1 11.979 -0.816 -3.053 9 H21 UVR 1 H21 UVR 1 13.002 -0.084 -1.063 10 H72 UVR 1 H72 UVR 1 13.177 2.403 0.127 11 H73 UVR 1 H73 UVR 1 13.496 3.606 -1.119 12 H71 UVR 1 H71 UVR 1 14.487 2.152 -1.032 13 H ILE 2 H ILE 2 10.746 -1.296 -0.043 14 HA ILE 2 H111 ILE 2 8.767 0.746 0.575 15 HB ILE 2 H121 ILE 2 8.267 -2.172 1.011 16 HG12 ILE 2 H142 ILE 2 8.759 -0.939 -1.723 17 HG13 ILE 2 H141 ILE 2 9.579 -2.336 -1.027 18 HG21 ILE 2 H133 ILE 2 6.099 -1.662 -0.007 19 HG22 ILE 2 H131 ILE 2 6.444 -0.411 1.189 20 HG23 ILE 2 H132 ILE 2 6.671 -0.086 -0.520 21 HD11 ILE 2 H153 ILE 2 7.059 -3.273 -0.842 22 HD12 ILE 2 H151 ILE 2 7.930 -3.410 -2.379 23 HD13 ILE 2 H152 ILE 2 6.758 -2.106 -2.126 24 H401 UVR 3 H401 UVR 3 1.448 -3.979 2.301 25 H271 UVR 3 H271 UVR 3 3.849 -2.986 6.120 26 H361 UVR 3 H361 UVR 3 3.860 3.316 -1.049 27 H272 UVR 3 H272 UVR 3 4.038 -1.694 4.938 28 H273 UVR 3 H273 UVR 3 4.392 -1.392 6.639 29 H353 UVR 3 H353 UVR 3 4.404 1.442 -2.312 30 H363 UVR 3 H363 UVR 3 4.782 2.240 0.002 31 H352 UVR 3 H352 UVR 3 5.110 2.326 -3.668 32 H362 UVR 3 H362 UVR 3 5.127 3.971 -0.013 33 H231 UVR 3 H231 UVR 3 5.297 -0.424 4.281 34 H223 UVR 3 H223 UVR 3 5.682 1.442 4.523 35 H232 UVR 3 H232 UVR 3 5.798 -0.037 2.681 36 H222 UVR 3 H222 UVR 3 5.878 1.738 6.248 37 H341 UVR 3 H341 UVR 3 5.990 3.842 -2.285 38 H351 UVR 3 H351 UVR 3 6.042 1.072 -2.852 39 H241 UVR 3 H241 UVR 3 6.630 -2.344 2.371 40 H221 UVR 3 H221 UVR 3 6.912 2.568 5.086 41 H292 UVR 3 H292 UVR 3 6.944 2.010 3.139 42 H201 UVR 3 H201 UVR 3 7.080 -0.189 6.163 43 H332 UVR 3 H332 UVR 3 7.403 1.403 -1.428 44 H191 UVR 3 H191 UVR 3 7.923 -1.261 4.296 45 H331 UVR 3 H331 UVR 3 8.034 3.006 -1.691 46 H291 UVR 3 H291 UVR 3 8.474 2.366 2.466 47 H212 UVR 3 H212 UVR 3 8.755 1.777 6.499 48 H213 UVR 3 H213 UVR 3 9.327 1.374 4.877 49 H211 UVR 3 H211 UVR 3 9.407 0.176 6.168 50 H511 UVR 4 H511 UVR 4 0.254 4.515 1.778 51 H451 UVR 4 H451 UVR 4 0.488 -0.871 -1.851 52 H551 UVR 4 H551 UVR 4 1.078 0.317 -4.007 53 H542 UVR 4 H542 UVR 4 1.079 1.775 -2.023 54 HAD UVR 4 HAD UVR 4 2.059 3.209 -3.050 55 H491 UVR 4 H491 UVR 4 2.070 -0.073 1.558 56 H561 UVR 4 H561 UVR 4 2.270 -1.623 -3.870 57 H541 UVR 4 H541 UVR 4 2.645 1.168 -1.524 58 HAA UVR 4 HAA UVR 4 2.940 3.607 3.971 59 HAB UVR 4 HAB UVR 4 2.961 -0.548 -0.406 60 H501 UVR 4 H501 UVR 4 2.983 1.454 3.093 61 H562 UVR 4 H562 UVR 4 3.207 -1.029 -2.492 62 H563 UVR 4 H563 UVR 4 3.711 -0.649 -4.142 63 H462 UVR 4 H462 UVR 4 -0.325 -0.467 0.429 64 H481 UVR 4 H481 UVR 4 -0.711 2.982 0.193 65 H461 UVR 4 H461 UVR 4 -0.770 0.795 -0.697 Start of MODEL 3 1 H31 UVR 1 H31 UVR 1 9.876 -0.064 -2.617 2 H42 UVR 1 H42 UVR 1 9.986 2.052 -3.928 3 H41 UVR 1 H41 UVR 1 10.189 2.330 -2.174 4 H32 UVR 1 H32 UVR 1 11.218 -0.079 -3.743 5 H52 UVR 1 H52 UVR 1 11.836 3.625 -3.472 6 H21 UVR 1 H21 UVR 1 12.002 -0.922 -1.599 7 H61 UVR 1 H61 UVR 1 12.432 2.827 -1.236 8 H51 UVR 1 H51 UVR 1 12.455 2.139 -4.198 9 H71 UVR 1 H71 UVR 1 13.623 1.295 0.217 10 H62 UVR 1 H62 UVR 1 13.856 2.811 -2.273 11 H73 UVR 1 H73 UVR 1 14.055 -0.321 -0.347 12 H72 UVR 1 H72 UVR 1 14.989 1.078 -0.876 13 H ILE 2 H ILE 2 10.715 -1.370 0.101 14 HA ILE 2 H111 ILE 2 8.746 0.753 0.562 15 HB ILE 2 H121 ILE 2 8.217 -2.154 1.031 16 HG12 ILE 2 H142 ILE 2 8.627 -0.989 -1.749 17 HG13 ILE 2 H141 ILE 2 9.576 -2.283 -1.017 18 HG21 ILE 2 H131 ILE 2 6.048 -1.659 0.044 19 HG22 ILE 2 H133 ILE 2 6.412 -0.355 1.175 20 HG23 ILE 2 H132 ILE 2 6.619 -0.113 -0.554 21 HD11 ILE 2 H151 ILE 2 7.449 -3.666 -0.846 22 HD12 ILE 2 H153 ILE 2 7.810 -3.248 -2.528 23 HD13 ILE 2 H152 ILE 2 6.566 -2.360 -1.636 24 H401 UVR 3 H401 UVR 3 1.400 -3.954 2.403 25 H362 UVR 3 H362 UVR 3 3.887 3.411 -0.998 26 H273 UVR 3 H273 UVR 3 3.996 -3.061 6.229 27 H271 UVR 3 H271 UVR 3 4.106 -1.754 5.054 28 H272 UVR 3 H272 UVR 3 4.551 -1.467 6.738 29 H352 UVR 3 H352 UVR 3 4.601 1.330 -2.240 30 H361 UVR 3 H361 UVR 3 4.716 2.136 -0.103 31 H351 UVR 3 H351 UVR 3 5.157 2.280 -3.621 32 H363 UVR 3 H363 UVR 3 5.169 3.826 0.140 33 H231 UVR 3 H231 UVR 3 5.282 -0.474 4.305 34 H223 UVR 3 H223 UVR 3 5.601 1.400 4.534 35 H232 UVR 3 H232 UVR 3 5.746 -0.076 2.698 36 H341 UVR 3 H341 UVR 3 5.888 3.911 -2.288 37 H222 UVR 3 H222 UVR 3 5.898 1.830 6.214 38 H353 UVR 3 H353 UVR 3 6.262 1.167 -2.817 39 H241 UVR 3 H241 UVR 3 6.598 -2.353 2.356 40 H292 UVR 3 H292 UVR 3 6.825 1.952 3.068 41 H221 UVR 3 H221 UVR 3 6.856 2.566 4.928 42 H201 UVR 3 H201 UVR 3 7.066 -0.142 6.155 43 H331 UVR 3 H331 UVR 3 7.629 1.693 -1.528 44 H191 UVR 3 H191 UVR 3 7.917 -1.252 4.296 45 H332 UVR 3 H332 UVR 3 8.021 3.396 -1.633 46 H291 UVR 3 H291 UVR 3 8.393 2.393 2.540 47 H213 UVR 3 H213 UVR 3 8.737 2.042 6.119 48 H212 UVR 3 H212 UVR 3 9.258 0.391 6.440 49 H211 UVR 3 H211 UVR 3 9.416 1.061 4.817 50 H501 UVR 4 H501 UVR 4 0.348 4.555 1.668 51 H451 UVR 4 H451 UVR 4 0.543 -0.908 -1.855 52 H551 UVR 4 H551 UVR 4 1.197 0.218 -4.014 53 H542 UVR 4 H542 UVR 4 1.219 1.714 -2.060 54 HAA UVR 4 HAA UVR 4 1.824 4.841 3.408 55 H481 UVR 4 H481 UVR 4 1.991 -0.101 1.601 56 HAD UVR 4 HAD UVR 4 2.274 3.021 -3.000 57 H562 UVR 4 H562 UVR 4 2.322 -1.752 -3.848 58 H541 UVR 4 H541 UVR 4 2.751 1.060 -1.526 59 H511 UVR 4 H511 UVR 4 2.864 1.403 3.170 60 HAB UVR 4 HAB UVR 4 2.986 -0.616 -0.370 61 H563 UVR 4 H563 UVR 4 3.207 -1.186 -2.424 62 H561 UVR 4 H561 UVR 4 3.811 -0.832 -4.043 63 H462 UVR 4 H462 UVR 4 -0.354 -0.419 0.358 64 H491 UVR 4 H491 UVR 4 -0.579 3.038 0.038 65 H461 UVR 4 H461 UVR 4 -0.691 0.844 -0.806 Start of MODEL 4 1 H51 UVR 1 H51 UVR 1 9.451 2.776 -2.615 2 H42 UVR 1 H42 UVR 1 9.537 0.511 -3.474 3 H52 UVR 1 H52 UVR 1 9.695 1.693 -1.242 4 H31 UVR 1 H31 UVR 1 10.660 -0.879 -1.991 5 H41 UVR 1 H41 UVR 1 11.036 1.364 -3.946 6 H62 UVR 1 H62 UVR 1 11.319 3.392 -0.901 7 H61 UVR 1 H61 UVR 1 11.685 3.503 -2.620 8 H32 UVR 1 H32 UVR 1 11.942 -0.626 -3.154 9 H21 UVR 1 H21 UVR 1 13.075 -0.146 -1.147 10 H73 UVR 1 H73 UVR 1 13.246 2.399 0.326 11 H71 UVR 1 H71 UVR 1 13.819 3.478 -0.945 12 H72 UVR 1 H72 UVR 1 14.546 1.884 -0.753 13 H ILE 2 H ILE 2 10.768 -1.403 -0.201 14 HA ILE 2 H111 ILE 2 8.855 0.644 0.457 15 HB ILE 2 H121 ILE 2 8.265 -2.249 0.878 16 HG12 ILE 2 H142 ILE 2 8.768 -1.014 -1.859 17 HG13 ILE 2 H141 ILE 2 9.630 -2.389 -1.165 18 HG21 ILE 2 H133 ILE 2 6.133 -1.648 -0.041 19 HG22 ILE 2 H132 ILE 2 6.587 -0.294 0.995 20 HG23 ILE 2 H131 ILE 2 6.783 -0.182 -0.741 21 HD11 ILE 2 H151 ILE 2 7.492 -3.696 -1.116 22 HD12 ILE 2 H152 ILE 2 7.808 -3.132 -2.764 23 HD13 ILE 2 H153 ILE 2 6.618 -2.300 -1.749 24 H401 UVR 3 H401 UVR 3 1.448 -3.951 2.467 25 H363 UVR 3 H363 UVR 3 3.777 3.237 -0.869 26 H272 UVR 3 H272 UVR 3 4.110 -2.853 6.168 27 H273 UVR 3 H273 UVR 3 4.147 -1.614 4.916 28 H351 UVR 3 H351 UVR 3 4.529 1.248 -2.138 29 H271 UVR 3 H271 UVR 3 4.603 -1.209 6.570 30 H362 UVR 3 H362 UVR 3 4.747 2.072 0.032 31 H353 UVR 3 H353 UVR 3 4.962 2.243 -3.531 32 H361 UVR 3 H361 UVR 3 5.066 3.800 0.192 33 H232 UVR 3 H232 UVR 3 5.280 -0.256 3.871 34 H221 UVR 3 H221 UVR 3 5.555 1.794 5.745 35 H341 UVR 3 H341 UVR 3 5.722 3.880 -2.215 36 H222 UVR 3 H222 UVR 3 5.829 1.661 4.010 37 H231 UVR 3 H231 UVR 3 6.010 -0.066 2.342 38 H352 UVR 3 H352 UVR 3 6.157 1.167 -2.816 39 H241 UVR 3 H241 UVR 3 6.630 -2.344 2.217 40 H201 UVR 3 H201 UVR 3 6.833 -0.017 5.969 41 H223 UVR 3 H223 UVR 3 6.843 2.721 4.980 42 H291 UVR 3 H291 UVR 3 7.425 2.242 3.089 43 H331 UVR 3 H331 UVR 3 7.552 1.707 -1.506 44 H332 UVR 3 H332 UVR 3 7.889 3.416 -1.664 45 H191 UVR 3 H191 UVR 3 7.892 -1.195 4.244 46 H211 UVR 3 H211 UVR 3 8.552 2.033 6.275 47 H292 UVR 3 H292 UVR 3 8.893 2.240 2.194 48 H213 UVR 3 H213 UVR 3 9.055 0.354 6.434 49 H212 UVR 3 H212 UVR 3 9.354 1.218 4.930 50 H501 UVR 4 H501 UVR 4 0.153 4.507 1.732 51 H451 UVR 4 H451 UVR 4 0.448 -0.950 -1.820 52 H542 UVR 4 H542 UVR 4 1.060 1.680 -2.065 53 H551 UVR 4 H551 UVR 4 1.077 0.148 -3.995 54 HAA UVR 4 HAA UVR 4 1.646 4.829 3.452 55 H481 UVR 4 H481 UVR 4 1.956 -0.091 1.599 56 HAD UVR 4 HAD UVR 4 2.107 3.000 -2.989 57 H561 UVR 4 H561 UVR 4 2.284 -1.768 -3.820 58 H541 UVR 4 H541 UVR 4 2.615 1.083 -1.528 59 H511 UVR 4 H511 UVR 4 2.800 1.437 3.171 60 HAB UVR 4 HAB UVR 4 2.910 -0.617 -0.387 61 H562 UVR 4 H562 UVR 4 3.151 -1.156 -2.405 62 H563 UVR 4 H563 UVR 4 3.735 -0.792 -4.030 63 H462 UVR 4 H462 UVR 4 -0.426 -0.468 0.405 64 H491 UVR 4 H491 UVR 4 -0.748 2.973 0.104 65 H461 UVR 4 H461 UVR 4 -0.802 0.785 -0.758 Start of MODEL 5 1 H52 UVR 1 H52 UVR 1 9.414 2.568 -2.712 2 H42 UVR 1 H42 UVR 1 9.614 0.262 -3.450 3 H51 UVR 1 H51 UVR 1 9.688 1.568 -1.283 4 H31 UVR 1 H31 UVR 1 10.802 -1.009 -1.915 5 H41 UVR 1 H41 UVR 1 11.068 1.166 -3.960 6 H62 UVR 1 H62 UVR 1 11.224 3.364 -1.020 7 H61 UVR 1 H61 UVR 1 11.616 3.387 -2.736 8 H32 UVR 1 H32 UVR 1 12.088 -0.718 -3.066 9 H21 UVR 1 H21 UVR 1 13.149 -0.107 -1.048 10 H72 UVR 1 H72 UVR 1 13.212 3.534 -0.477 11 H71 UVR 1 H71 UVR 1 13.586 1.970 0.244 12 H73 UVR 1 H73 UVR 1 14.537 2.565 -1.118 13 H ILE 2 H ILE 2 10.784 -1.391 -0.126 14 HA ILE 2 H111 ILE 2 8.870 0.688 0.488 15 HB ILE 2 H121 ILE 2 8.243 -2.199 0.921 16 HG12 ILE 2 H142 ILE 2 8.920 -1.001 -1.788 17 HG13 ILE 2 H141 ILE 2 9.617 -2.454 -1.076 18 HG21 ILE 2 H132 ILE 2 6.159 -1.566 -0.184 19 HG22 ILE 2 H131 ILE 2 6.537 -0.318 1.004 20 HG23 ILE 2 H133 ILE 2 6.863 -0.045 -0.696 21 HD11 ILE 2 H152 ILE 2 7.267 -3.482 -1.110 22 HD12 ILE 2 H153 ILE 2 7.880 -3.122 -2.732 23 HD13 ILE 2 H151 ILE 2 6.711 -2.041 -1.959 24 H401 UVR 3 H401 UVR 3 1.372 -3.879 2.530 25 H363 UVR 3 H363 UVR 3 3.780 3.319 -0.998 26 H273 UVR 3 H273 UVR 3 4.207 -3.020 6.080 27 H271 UVR 3 H271 UVR 3 4.238 -1.590 5.052 28 H353 UVR 3 H353 UVR 3 4.509 1.264 -2.258 29 H362 UVR 3 H362 UVR 3 4.635 2.066 -0.093 30 H272 UVR 3 H272 UVR 3 4.744 -1.476 6.741 31 H352 UVR 3 H352 UVR 3 4.993 2.279 -3.619 32 H361 UVR 3 H361 UVR 3 5.057 3.764 0.131 33 H232 UVR 3 H232 UVR 3 5.259 -0.297 3.896 34 H222 UVR 3 H222 UVR 3 5.519 1.637 5.839 35 H223 UVR 3 H223 UVR 3 5.801 1.610 4.101 36 H341 UVR 3 H341 UVR 3 5.803 3.860 -2.257 37 H231 UVR 3 H231 UVR 3 5.971 -0.064 2.367 38 H351 UVR 3 H351 UVR 3 6.147 1.157 -2.907 39 H241 UVR 3 H241 UVR 3 6.567 -2.328 2.156 40 H221 UVR 3 H221 UVR 3 6.786 2.638 5.133 41 H201 UVR 3 H201 UVR 3 6.861 -0.127 5.996 42 H291 UVR 3 H291 UVR 3 7.302 2.206 3.108 43 H332 UVR 3 H332 UVR 3 7.475 1.579 -1.450 44 H191 UVR 3 H191 UVR 3 7.883 -1.237 4.207 45 H331 UVR 3 H331 UVR 3 7.922 3.249 -1.656 46 H213 UVR 3 H213 UVR 3 8.504 1.739 6.582 47 H292 UVR 3 H292 UVR 3 8.780 2.277 2.232 48 H211 UVR 3 H211 UVR 3 9.195 1.528 4.973 49 H212 UVR 3 H212 UVR 3 9.230 0.201 6.127 50 H511 UVR 4 H511 UVR 4 0.335 4.587 1.806 51 H451 UVR 4 H451 UVR 4 0.406 -0.888 -1.782 52 H551 UVR 4 H551 UVR 4 1.075 0.134 -3.976 53 H542 UVR 4 H542 UVR 4 1.140 1.706 -2.078 54 H491 UVR 4 H491 UVR 4 1.988 -0.062 1.593 55 H562 UVR 4 H562 UVR 4 2.189 -1.837 -3.747 56 HAD UVR 4 HAD UVR 4 2.215 2.968 -3.059 57 H541 UVR 4 H541 UVR 4 2.669 1.046 -1.536 58 H501 UVR 4 H501 UVR 4 2.885 1.410 3.186 59 HAA UVR 4 HAA UVR 4 2.892 3.537 4.095 60 HAB UVR 4 HAB UVR 4 2.893 -0.643 -0.381 61 H563 UVR 4 H563 UVR 4 3.127 -1.218 -2.380 62 H561 UVR 4 H561 UVR 4 3.672 -0.933 -4.034 63 H462 UVR 4 H462 UVR 4 -0.440 -0.332 0.433 64 H481 UVR 4 H481 UVR 4 -0.620 3.106 0.157 65 H461 UVR 4 H461 UVR 4 -0.746 0.933 -0.739 Start of MODEL 6 1 H52 UVR 1 H52 UVR 1 9.333 2.663 -2.976 2 H42 UVR 1 H42 UVR 1 9.437 0.317 -3.581 3 H51 UVR 1 H51 UVR 1 9.556 1.736 -1.489 4 H31 UVR 1 H31 UVR 1 10.535 -0.894 -1.928 5 H41 UVR 1 H41 UVR 1 10.943 1.117 -4.118 6 H62 UVR 1 H62 UVR 1 11.170 3.470 -1.307 7 H61 UVR 1 H61 UVR 1 11.566 3.393 -3.021 8 H32 UVR 1 H32 UVR 1 11.835 -0.776 -3.096 9 H21 UVR 1 H21 UVR 1 12.937 -0.071 -1.143 10 H72 UVR 1 H72 UVR 1 13.285 2.290 0.072 11 H73 UVR 1 H73 UVR 1 13.391 3.630 -1.068 12 H71 UVR 1 H71 UVR 1 14.474 2.248 -1.234 13 H ILE 2 H ILE 2 10.715 -1.278 -0.063 14 HA ILE 2 H111 ILE 2 8.743 0.759 0.579 15 HB ILE 2 H121 ILE 2 8.237 -2.141 1.056 16 HG12 ILE 2 H142 ILE 2 8.631 -0.991 -1.737 17 HG13 ILE 2 H141 ILE 2 9.576 -2.290 -1.010 18 HG21 ILE 2 H131 ILE 2 6.060 -1.626 0.103 19 HG22 ILE 2 H133 ILE 2 6.466 -0.302 1.197 20 HG23 ILE 2 H132 ILE 2 6.652 -0.106 -0.535 21 HD11 ILE 2 H151 ILE 2 7.471 -3.669 -0.813 22 HD12 ILE 2 H152 ILE 2 7.795 -3.242 -2.499 23 HD13 ILE 2 H153 ILE 2 6.565 -2.364 -1.579 24 H401 UVR 3 H401 UVR 3 1.585 -4.073 2.170 25 H361 UVR 3 H361 UVR 3 3.872 3.380 -0.940 26 H271 UVR 3 H271 UVR 3 3.948 -3.149 6.026 27 H272 UVR 3 H272 UVR 3 4.118 -1.793 4.917 28 H273 UVR 3 H273 UVR 3 4.449 -1.572 6.634 29 H363 UVR 3 H363 UVR 3 4.699 2.135 -0.004 30 H353 UVR 3 H353 UVR 3 4.745 1.082 -1.971 31 H352 UVR 3 H352 UVR 3 4.857 2.117 -3.395 32 H362 UVR 3 H362 UVR 3 5.169 3.828 0.165 33 H231 UVR 3 H231 UVR 3 5.325 -0.478 4.300 34 H222 UVR 3 H222 UVR 3 5.667 1.650 6.141 35 H223 UVR 3 H223 UVR 3 5.712 1.478 4.388 36 H232 UVR 3 H232 UVR 3 5.814 -0.036 2.708 37 H341 UVR 3 H341 UVR 3 5.849 3.802 -2.269 38 H351 UVR 3 H351 UVR 3 6.254 1.177 -2.887 39 H241 UVR 3 H241 UVR 3 6.717 -2.294 2.348 40 H221 UVR 3 H221 UVR 3 6.801 2.605 5.187 41 H201 UVR 3 H201 UVR 3 7.007 -0.149 6.175 42 H291 UVR 3 H291 UVR 3 7.100 2.139 3.208 43 H331 UVR 3 H331 UVR 3 7.618 1.649 -1.415 44 H191 UVR 3 H191 UVR 3 7.953 -1.225 4.341 45 H332 UVR 3 H332 UVR 3 7.975 3.354 -1.580 46 H292 UVR 3 H292 UVR 3 8.617 2.352 2.427 47 H213 UVR 3 H213 UVR 3 8.618 1.944 6.471 48 H212 UVR 3 H212 UVR 3 9.273 0.312 6.396 49 H211 UVR 3 H211 UVR 3 9.325 1.343 4.969 50 H451 UVR 4 H451 UVR 4 0.512 -0.868 -1.767 51 H501 UVR 4 H501 UVR 4 0.624 4.677 1.740 52 H551 UVR 4 H551 UVR 4 1.099 0.051 -4.029 53 H542 UVR 4 H542 UVR 4 1.184 1.740 -2.215 54 H481 UVR 4 H481 UVR 4 1.959 -0.079 1.627 55 HAA UVR 4 HAA UVR 4 2.088 4.837 3.507 56 H562 UVR 4 H562 UVR 4 2.304 -1.856 -3.763 57 HAD UVR 4 HAD UVR 4 2.647 2.905 -3.048 58 H541 UVR 4 H541 UVR 4 2.730 1.121 -1.680 59 H511 UVR 4 H511 UVR 4 2.899 1.347 3.230 60 HAB UVR 4 HAB UVR 4 2.982 -0.424 -0.316 61 H563 UVR 4 H563 UVR 4 3.201 -1.157 -2.409 62 H561 UVR 4 H561 UVR 4 3.756 -0.907 -4.066 63 H462 UVR 4 H462 UVR 4 -0.372 -0.232 0.372 64 H491 UVR 4 H491 UVR 4 -0.376 3.244 0.066 65 H461 UVR 4 H461 UVR 4 -0.642 1.045 -0.785 Start of MODEL 7 1 H51 UVR 1 H51 UVR 1 9.928 1.667 -1.940 2 H52 UVR 1 H52 UVR 1 10.097 2.477 -3.502 3 H42 UVR 1 H42 UVR 1 10.300 0.101 -3.908 4 H31 UVR 1 H31 UVR 1 10.845 -0.916 -1.870 5 H62 UVR 1 H62 UVR 1 11.482 3.369 -1.458 6 H41 UVR 1 H41 UVR 1 11.925 0.838 -4.071 7 H61 UVR 1 H61 UVR 1 12.245 3.239 -3.037 8 H32 UVR 1 H32 UVR 1 12.369 -1.043 -2.730 9 H21 UVR 1 H21 UVR 1 13.160 -0.128 -0.730 10 H71 UVR 1 H71 UVR 1 13.262 2.394 0.355 11 H72 UVR 1 H72 UVR 1 13.736 3.561 -0.879 12 H73 UVR 1 H73 UVR 1 14.709 2.115 -0.619 13 H ILE 2 H ILE 2 10.791 -1.233 0.019 14 HA ILE 2 H111 ILE 2 8.778 0.832 0.523 15 HB ILE 2 H121 ILE 2 8.313 -2.100 0.896 16 HG12 ILE 2 H142 ILE 2 8.919 -0.788 -1.773 17 HG13 ILE 2 H141 ILE 2 9.656 -2.242 -1.098 18 HG21 ILE 2 H132 ILE 2 6.168 -1.614 -0.101 19 HG22 ILE 2 H131 ILE 2 6.487 -0.310 1.039 20 HG23 ILE 2 H133 ILE 2 6.728 -0.062 -0.676 21 HD11 ILE 2 H151 ILE 2 7.016 -2.995 -1.061 22 HD12 ILE 2 H152 ILE 2 8.043 -3.289 -2.475 23 HD13 ILE 2 H153 ILE 2 6.971 -1.881 -2.425 24 H401 UVR 3 H401 UVR 3 1.401 -4.014 2.435 25 H363 UVR 3 H363 UVR 3 3.686 3.265 -0.851 26 H271 UVR 3 H271 UVR 3 4.115 -3.056 6.117 27 H272 UVR 3 H272 UVR 3 4.123 -1.746 4.941 28 H353 UVR 3 H353 UVR 3 4.391 1.287 -2.165 29 H273 UVR 3 H273 UVR 3 4.588 -1.432 6.613 30 H362 UVR 3 H362 UVR 3 4.621 2.062 0.041 31 H352 UVR 3 H352 UVR 3 4.819 2.332 -3.522 32 H361 UVR 3 H361 UVR 3 4.983 3.781 0.224 33 H232 UVR 3 H232 UVR 3 5.204 -0.355 3.918 34 H221 UVR 3 H221 UVR 3 5.502 1.595 5.994 35 H222 UVR 3 H222 UVR 3 5.641 1.516 4.242 36 H341 UVR 3 H341 UVR 3 5.679 3.885 -2.168 37 H231 UVR 3 H231 UVR 3 5.906 -0.094 2.392 38 H351 UVR 3 H351 UVR 3 6.004 1.200 -2.880 39 H241 UVR 3 H241 UVR 3 6.568 -2.354 2.175 40 H223 UVR 3 H223 UVR 3 6.705 2.573 5.158 41 H201 UVR 3 H201 UVR 3 6.812 -0.219 6.023 42 H291 UVR 3 H291 UVR 3 7.067 2.170 3.158 43 H332 UVR 3 H332 UVR 3 7.376 1.578 -1.457 44 H331 UVR 3 H331 UVR 3 7.828 3.247 -1.687 45 H191 UVR 3 H191 UVR 3 7.859 -1.239 4.198 46 H211 UVR 3 H211 UVR 3 8.424 1.760 6.562 47 H292 UVR 3 H292 UVR 3 8.573 2.391 2.367 48 H213 UVR 3 H213 UVR 3 9.120 0.170 6.270 49 H212 UVR 3 H212 UVR 3 9.158 1.391 5.000 50 H501 UVR 4 H501 UVR 4 0.139 4.497 1.881 51 H451 UVR 4 H451 UVR 4 0.320 -0.921 -1.740 52 H542 UVR 4 H542 UVR 4 0.926 1.700 -2.000 53 H551 UVR 4 H551 UVR 4 0.945 0.158 -3.919 54 HAA UVR 4 HAA UVR 4 1.649 4.774 3.592 55 H481 UVR 4 H481 UVR 4 1.881 -0.121 1.660 56 HAD UVR 4 HAD UVR 4 2.005 3.024 -2.915 57 H561 UVR 4 H561 UVR 4 2.134 -1.773 -3.649 58 H541 UVR 4 H541 UVR 4 2.486 1.118 -1.466 59 H511 UVR 4 H511 UVR 4 2.756 1.371 3.247 60 HAB UVR 4 HAB UVR 4 2.807 -0.593 -0.338 61 H562 UVR 4 H562 UVR 4 3.097 -1.085 -2.335 62 H563 UVR 4 H563 UVR 4 3.563 -0.813 -4.016 63 H462 UVR 4 H462 UVR 4 -0.508 -0.454 0.499 64 H491 UVR 4 H491 UVR 4 -0.796 2.999 0.237 65 H461 UVR 4 H461 UVR 4 -0.900 0.816 -0.640 Start of MODEL 8 1 H41 UVR 1 H41 UVR 1 10.290 -0.817 -2.986 2 H42 UVR 1 H42 UVR 1 10.963 -2.219 -3.858 3 H61 UVR 1 H61 UVR 1 11.315 1.385 -3.155 4 H51 UVR 1 H51 UVR 1 11.430 -0.130 -5.076 5 H32 UVR 1 H32 UVR 1 11.461 -2.347 -1.423 6 H72 UVR 1 H72 UVR 1 12.594 2.079 -0.631 7 H62 UVR 1 H62 UVR 1 12.837 1.609 -4.016 8 H52 UVR 1 H52 UVR 1 12.941 -0.816 -4.466 9 H31 UVR 1 H31 UVR 1 12.953 -2.162 -2.363 10 H21 UVR 1 H21 UVR 1 13.038 -0.644 -0.461 11 H73 UVR 1 H73 UVR 1 13.312 2.746 -2.096 12 H71 UVR 1 H71 UVR 1 14.311 1.841 -0.959 13 H ILE 2 H ILE 2 10.975 -1.367 0.645 14 HA ILE 2 H111 ILE 2 8.839 0.698 0.540 15 HB ILE 2 H121 ILE 2 8.288 -2.215 0.989 16 HG12 ILE 2 H142 ILE 2 8.808 -0.986 -1.741 17 HG13 ILE 2 H141 ILE 2 9.648 -2.361 -1.016 18 HG21 ILE 2 H133 ILE 2 6.138 -1.713 -0.062 19 HG22 ILE 2 H132 ILE 2 6.452 -0.456 1.143 20 HG23 ILE 2 H131 ILE 2 6.711 -0.136 -0.566 21 HD11 ILE 2 H152 ILE 2 7.355 -3.545 -0.922 22 HD12 ILE 2 H153 ILE 2 7.940 -3.262 -2.570 23 HD13 ILE 2 H151 ILE 2 6.702 -2.206 -1.863 24 H401 UVR 3 H401 UVR 3 1.406 -3.939 2.419 25 H361 UVR 3 H361 UVR 3 3.806 3.117 -1.023 26 H273 UVR 3 H273 UVR 3 4.022 -3.103 6.098 27 H271 UVR 3 H271 UVR 3 4.153 -1.701 5.041 28 H352 UVR 3 H352 UVR 3 4.533 1.186 -2.267 29 H272 UVR 3 H272 UVR 3 4.557 -1.556 6.755 30 H363 UVR 3 H363 UVR 3 4.803 2.079 -0.004 31 H351 UVR 3 H351 UVR 3 4.956 2.220 -3.633 32 H362 UVR 3 H362 UVR 3 5.055 3.826 -0.003 33 H231 UVR 3 H231 UVR 3 5.272 -0.457 4.228 34 H221 UVR 3 H221 UVR 3 5.598 1.440 4.347 35 H223 UVR 3 H223 UVR 3 5.682 1.778 6.072 36 H232 UVR 3 H232 UVR 3 5.787 -0.070 2.636 37 H341 UVR 3 H341 UVR 3 5.872 3.768 -2.313 38 H353 UVR 3 H353 UVR 3 6.140 1.087 -2.988 39 H241 UVR 3 H241 UVR 3 6.622 -2.344 2.317 40 H222 UVR 3 H222 UVR 3 6.733 2.637 4.946 41 H292 UVR 3 H292 UVR 3 6.907 1.980 3.027 42 H201 UVR 3 H201 UVR 3 7.012 -0.056 6.133 43 H332 UVR 3 H332 UVR 3 7.457 1.407 -1.542 44 H191 UVR 3 H191 UVR 3 7.898 -1.221 4.329 45 H331 UVR 3 H331 UVR 3 7.987 3.054 -1.785 46 H291 UVR 3 H291 UVR 3 8.464 2.350 2.429 47 H212 UVR 3 H212 UVR 3 8.619 2.206 5.983 48 H211 UVR 3 H211 UVR 3 9.141 0.607 6.499 49 H213 UVR 3 H213 UVR 3 9.374 1.108 4.825 50 H501 UVR 4 H501 UVR 4 0.177 4.516 1.909 51 H451 UVR 4 H451 UVR 4 0.498 -0.871 -1.809 52 H551 UVR 4 H551 UVR 4 1.021 0.280 -3.940 53 H542 UVR 4 H542 UVR 4 1.257 1.791 -1.962 54 HAA UVR 4 HAA UVR 4 1.694 4.770 3.623 55 H481 UVR 4 H481 UVR 4 1.998 -0.058 1.570 56 H563 UVR 4 H563 UVR 4 2.172 -1.705 -3.787 57 H541 UVR 4 H541 UVR 4 2.770 1.006 -1.540 58 H511 UVR 4 H511 UVR 4 2.851 1.393 3.176 59 HAD UVR 4 HAD UVR 4 2.901 3.590 -4.402 60 HAB UVR 4 HAB UVR 4 2.943 -0.580 -0.350 61 H561 UVR 4 H561 UVR 4 3.266 -1.062 -2.557 62 H562 UVR 4 H562 UVR 4 3.586 -0.774 -4.270 63 H462 UVR 4 H462 UVR 4 -0.426 -0.381 0.381 64 H491 UVR 4 H491 UVR 4 -0.740 3.042 0.227 65 H461 UVR 4 H461 UVR 4 -0.744 0.900 -0.769 Start of MODEL 9 1 H41 UVR 1 H41 UVR 1 9.599 1.030 -2.197 2 H42 UVR 1 H42 UVR 1 9.613 0.222 -3.784 3 H51 UVR 1 H51 UVR 1 10.259 2.591 -3.994 4 H31 UVR 1 H31 UVR 1 10.697 -1.173 -2.022 5 H61 UVR 1 H61 UVR 1 11.093 2.888 -1.707 6 H52 UVR 1 H52 UVR 1 11.641 1.559 -4.384 7 H32 UVR 1 H32 UVR 1 11.846 -0.734 -3.274 8 H62 UVR 1 H62 UVR 1 12.314 3.403 -2.866 9 H21 UVR 1 H21 UVR 1 12.905 -0.391 -1.104 10 H73 UVR 1 H73 UVR 1 13.223 3.295 -0.676 11 H72 UVR 1 H72 UVR 1 13.449 1.753 0.144 12 H71 UVR 1 H71 UVR 1 14.609 2.280 -1.077 13 H ILE 2 H ILE 2 10.720 -1.352 -0.016 14 HA ILE 2 H111 ILE 2 8.785 0.759 0.526 15 HB ILE 2 H121 ILE 2 8.229 -2.135 1.020 16 HG12 ILE 2 H142 ILE 2 8.718 -0.998 -1.759 17 HG13 ILE 2 H141 ILE 2 9.571 -2.344 -1.012 18 HG21 ILE 2 H131 ILE 2 6.067 -1.600 0.048 19 HG22 ILE 2 H133 ILE 2 6.475 -0.281 1.142 20 HG23 ILE 2 H132 ILE 2 6.676 -0.085 -0.589 21 HD11 ILE 2 H153 ILE 2 7.393 -3.615 -0.890 22 HD12 ILE 2 H151 ILE 2 7.800 -3.203 -2.561 23 HD13 ILE 2 H152 ILE 2 6.582 -2.265 -1.685 24 H401 UVR 3 H401 UVR 3 1.521 -4.032 2.297 25 H361 UVR 3 H361 UVR 3 3.772 3.344 -0.970 26 H273 UVR 3 H273 UVR 3 4.013 -3.039 6.126 27 H271 UVR 3 H271 UVR 3 4.140 -1.747 4.937 28 H272 UVR 3 H272 UVR 3 4.542 -1.434 6.626 29 H351 UVR 3 H351 UVR 3 4.606 1.255 -2.126 30 H363 UVR 3 H363 UVR 3 4.681 2.167 -0.021 31 H353 UVR 3 H353 UVR 3 4.997 2.244 -3.535 32 H362 UVR 3 H362 UVR 3 5.030 3.891 0.138 33 H231 UVR 3 H231 UVR 3 5.307 -0.426 4.246 34 H222 UVR 3 H222 UVR 3 5.678 1.729 6.064 35 H221 UVR 3 H221 UVR 3 5.718 1.531 4.314 36 H341 UVR 3 H341 UVR 3 5.766 3.919 -2.269 37 H232 UVR 3 H232 UVR 3 5.801 -0.015 2.651 38 H352 UVR 3 H352 UVR 3 6.232 1.220 -2.814 39 H241 UVR 3 H241 UVR 3 6.673 -2.281 2.312 40 H223 UVR 3 H223 UVR 3 6.823 2.657 5.097 41 H201 UVR 3 H201 UVR 3 6.992 -0.086 6.122 42 H291 UVR 3 H291 UVR 3 7.091 2.163 3.126 43 H331 UVR 3 H331 UVR 3 7.586 1.783 -1.469 44 H332 UVR 3 H332 UVR 3 7.909 3.501 -1.572 45 H191 UVR 3 H191 UVR 3 7.936 -1.193 4.299 46 H292 UVR 3 H292 UVR 3 8.616 2.372 2.370 47 H212 UVR 3 H212 UVR 3 8.634 1.926 6.472 48 H213 UVR 3 H213 UVR 3 9.298 1.445 4.910 49 H211 UVR 3 H211 UVR 3 9.302 0.311 6.255 50 H501 UVR 4 H501 UVR 4 0.241 4.485 1.792 51 H451 UVR 4 H451 UVR 4 0.518 -0.918 -1.838 52 H551 UVR 4 H551 UVR 4 1.104 0.218 -4.009 53 H542 UVR 4 H542 UVR 4 1.104 1.723 -2.056 54 HAA UVR 4 HAA UVR 4 1.742 4.786 3.508 55 HAD UVR 4 HAD UVR 4 1.827 3.090 -3.212 56 H481 UVR 4 H481 UVR 4 2.034 -0.114 1.590 57 H562 UVR 4 H562 UVR 4 2.347 -1.683 -3.905 58 H541 UVR 4 H541 UVR 4 2.670 1.127 -1.551 59 H511 UVR 4 H511 UVR 4 2.890 1.392 3.179 60 HAB UVR 4 HAB UVR 4 2.980 -0.557 -0.388 61 H563 UVR 4 H563 UVR 4 3.192 -1.105 -2.464 62 H561 UVR 4 H561 UVR 4 3.789 -0.685 -4.071 63 H462 UVR 4 H462 UVR 4 -0.332 -0.477 0.399 64 H491 UVR 4 H491 UVR 4 -0.668 2.975 0.149 65 H461 UVR 4 H461 UVR 4 -0.735 0.792 -0.735 Start of MODEL 10 1 H41 UVR 1 H41 UVR 1 10.322 -0.206 -2.973 2 H42 UVR 1 H42 UVR 1 10.961 -1.478 -4.047 3 H31 UVR 1 H31 UVR 1 11.418 -1.954 -1.628 4 H61 UVR 1 H61 UVR 1 11.435 1.944 -2.758 5 H51 UVR 1 H51 UVR 1 11.472 0.773 -4.920 6 H32 UVR 1 H32 UVR 1 12.909 -1.780 -2.542 7 H62 UVR 1 H62 UVR 1 12.936 2.287 -3.618 8 H72 UVR 1 H72 UVR 1 12.963 2.095 -0.122 9 H52 UVR 1 H52 UVR 1 12.967 -0.052 -4.465 10 H21 UVR 1 H21 UVR 1 13.128 -0.516 -0.468 11 H73 UVR 1 H73 UVR 1 13.348 3.083 -1.529 12 H71 UVR 1 H71 UVR 1 14.592 2.069 -0.802 13 H ILE 2 H ILE 2 10.904 -1.368 0.359 14 HA ILE 2 H111 ILE 2 8.876 0.798 0.504 15 HB ILE 2 H121 ILE 2 8.283 -2.105 0.919 16 HG12 ILE 2 H142 ILE 2 8.937 -0.908 -1.792 17 HG13 ILE 2 H141 ILE 2 9.692 -2.313 -1.034 18 HG21 ILE 2 H132 ILE 2 6.194 -1.575 -0.209 19 HG22 ILE 2 H131 ILE 2 6.490 -0.313 0.986 20 HG23 ILE 2 H133 ILE 2 6.819 -0.018 -0.713 21 HD11 ILE 2 H153 ILE 2 7.047 -3.076 -0.963 22 HD12 ILE 2 H151 ILE 2 8.098 -3.475 -2.334 23 HD13 ILE 2 H152 ILE 2 7.020 -2.071 -2.409 24 H401 UVR 3 H401 UVR 3 1.297 -3.848 2.602 25 H361 UVR 3 H361 UVR 3 3.704 3.312 -0.889 26 H271 UVR 3 H271 UVR 3 4.205 -1.653 5.065 27 H273 UVR 3 H273 UVR 3 4.206 -3.013 6.185 28 H352 UVR 3 H352 UVR 3 4.499 1.358 -2.228 29 H363 UVR 3 H363 UVR 3 4.643 2.075 -0.049 30 H272 UVR 3 H272 UVR 3 4.757 -1.428 6.726 31 H362 UVR 3 H362 UVR 3 4.978 3.786 0.236 32 H351 UVR 3 H351 UVR 3 5.104 2.305 -3.591 33 H232 UVR 3 H232 UVR 3 5.217 -0.354 3.902 34 H223 UVR 3 H223 UVR 3 5.597 1.458 4.333 35 H341 UVR 3 H341 UVR 3 5.623 3.981 -2.222 36 H222 UVR 3 H222 UVR 3 5.764 1.774 6.054 37 H231 UVR 3 H231 UVR 3 5.903 -0.126 2.368 38 H353 UVR 3 H353 UVR 3 6.193 1.231 -2.719 39 H241 UVR 3 H241 UVR 3 6.514 -2.384 2.151 40 H221 UVR 3 H221 UVR 3 6.849 2.551 4.900 41 H201 UVR 3 H201 UVR 3 6.889 -0.213 5.992 42 H292 UVR 3 H292 UVR 3 6.893 1.981 2.995 43 H331 UVR 3 H331 UVR 3 7.588 1.936 -1.574 44 H332 UVR 3 H332 UVR 3 7.803 3.677 -1.581 45 H191 UVR 3 H191 UVR 3 7.870 -1.272 4.150 46 H291 UVR 3 H291 UVR 3 8.466 2.408 2.496 47 H213 UVR 3 H213 UVR 3 8.591 1.858 6.268 48 H212 UVR 3 H212 UVR 3 9.124 0.180 6.339 49 H211 UVR 3 H211 UVR 3 9.312 1.100 4.844 50 H501 UVR 4 H501 UVR 4 0.053 4.450 1.851 51 H451 UVR 4 H451 UVR 4 0.473 -0.907 -1.849 52 H551 UVR 4 H551 UVR 4 1.141 0.231 -3.946 53 H542 UVR 4 H542 UVR 4 1.229 1.721 -1.968 54 HAA UVR 4 HAA UVR 4 1.522 4.757 3.588 55 H481 UVR 4 H481 UVR 4 1.984 -0.086 1.579 56 H562 UVR 4 H562 UVR 4 2.245 -1.751 -3.804 57 H541 UVR 4 H541 UVR 4 2.740 0.987 -1.454 58 H511 UVR 4 H511 UVR 4 2.775 1.403 3.206 59 HAB UVR 4 HAB UVR 4 2.912 -0.736 -0.397 60 H563 UVR 4 H563 UVR 4 3.160 -1.203 -2.390 61 HAD UVR 4 HAD UVR 4 3.598 0.229 -5.638 62 H561 UVR 4 H561 UVR 4 3.741 -0.846 -4.021 63 H462 UVR 4 H462 UVR 4 -0.424 -0.468 0.385 64 H461 UVR 4 H461 UVR 4 -0.777 0.797 -0.774 65 H491 UVR 4 H491 UVR 4 -0.793 2.946 0.167