# # Creating user name: andrew InsightII # Creation time: Fri Nov 5 10:53:53 2004 @MOLECULE FINALC6 463 497 13 0 0 SMALL USER_CHARGES @ATOM 1 O5' -6.9659 11.0356 5.7672 O.3 1 A1 -0.3800 **** 2 H5' -6.0603 11.3513 6.1428 H 1 A1 0.3500 **** 3 O3' -9.4167 9.6852 2.6130 O.3 1 A1 -0.5000 **** 4 C1' -6.4268 9.7835 2.7267 C.3 1 A1 0.1600 **** 5 H1' -6.5585 9.4179 1.7084 H 1 A1 0.1000 **** 6 C2' -7.3620 9.0630 3.6891 C.3 1 A1 -0.2000 **** 7 H2'1 -7.6342 8.0689 3.3347 H 1 A1 0.1000 **** 8 H2'2 -6.9265 8.9496 4.6818 H 1 A1 0.1000 **** 9 C3' -8.5662 9.9904 3.7155 C.3 1 A1 0.0500 **** 10 H3' -9.1312 9.8990 4.6431 H 1 A1 0.1000 **** 11 C4' -7.9325 11.3742 3.5901 C.3 1 A1 0.0500 **** 12 H4' -8.6770 12.0232 3.1290 H 1 A1 0.1000 **** 13 C5' -7.4853 12.0269 4.8772 C.3 1 A1 -0.1700 **** 14 H5'1 -6.7135 12.7639 4.6554 H 1 A1 0.1000 **** 15 H5'2 -8.3362 12.5276 5.3391 H 1 A1 0.1000 **** 16 O4' -6.7594 11.1583 2.7427 O.3 1 A1 -0.3000 **** 17 N6 -0.4127 9.2102 2.8958 N.2 1 A1 -0.6650 **** 18 H61 0.4506 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C20 5.0418 2.1279 -2.5304 C.3 7 NPCN1 0.0500 **** 251 H26 4.9680 3.2042 -2.2809 H 7 NPCN1 0.1000 **** 252 O7 6.1098 1.8845 -3.4940 O.3 7 NPCN1 -0.3000 **** 253 C21 6.5477 2.9790 -4.3317 C.3 7 NPCN1 0.2000 **** 254 O8 5.9847 2.8003 -5.6418 O.3 7 NPCN1 -0.3000 **** 255 H27 6.2858 3.9717 -3.9099 H 7 NPCN1 0.1000 **** 256 C212 8.0743 2.8995 -4.4986 C.3 7 NPCN1 -0.2000 **** 257 H28 8.3815 3.6935 -5.2039 H 7 NPCN1 0.1000 **** 258 C2122 8.8882 3.0230 -3.1992 C.3 7 NPCN1 -0.0700 **** 259 C32 10.3915 3.0509 -3.4663 C.3 7 NPCN1 -0.3000 **** 260 H29 10.9606 3.1052 -2.5202 H 7 NPCN1 0.1000 **** 261 H30 10.7317 2.1404 -3.9941 H 7 NPCN1 0.1000 **** 262 H31 10.6879 3.9226 -4.0777 H 7 NPCN1 0.1000 **** 263 H32 8.5941 3.9349 -2.6400 H 7 NPCN1 0.1000 **** 264 O36 8.6250 1.8766 -2.4140 O.3 7 NPCN1 -0.3800 **** 265 H33 7.8143 1.5070 -2.7887 H 7 NPCN1 0.3500 **** 266 H34 8.3273 1.9508 -5.0093 H 7 NPCN1 0.1000 **** 267 C22 5.4330 1.3434 -1.2389 C.3 7 NPCN1 0.0500 **** 268 C23 4.6783 1.7635 0.0386 C.3 7 NPCN1 -0.3000 **** 269 H35 5.0885 1.2517 0.9285 H 7 NPCN1 0.1000 **** 270 H36 4.7661 2.8489 0.2287 H 7 NPCN1 0.1000 **** 271 H37 3.6019 1.5196 -0.0014 H 7 NPCN1 0.1000 **** 272 H38 6.4994 1.5629 -1.0388 H 7 NPCN1 0.1000 **** 273 O9 5.3234 -0.1036 -1.4475 O.3 7 NPCN1 -0.3000 **** 274 O5' -7.4382 -11.1768 5.3706 O.3 8 A1 -0.3800 **** 275 H5' -7.7001 -10.4060 6.0016 H 8 A1 0.3500 **** 276 O3' -4.9232 -9.7772 8.4519 O.3 8 A1 -0.5000 **** 277 C1' -4.3507 -9.9323 5.5176 C.3 8 A1 0.1600 **** 278 H1' -3.3882 -9.5633 5.8717 H 8 A1 0.1000 **** 279 C2' -5.4990 -9.1951 6.1944 C.3 8 A1 -0.2000 **** 280 H2'1 -5.2128 -8.1957 6.5218 H 8 A1 0.1000 **** 281 H2'2 -6.3654 -9.0909 5.5414 H 8 A1 0.1000 **** 282 C3' -5.8031 -10.0995 7.3778 C.3 8 A1 0.0500 **** 283 H3' -6.8350 -9.9983 7.7139 H 8 A1 0.1000 **** 284 C4' -5.5409 -11.4950 6.8155 C.3 8 A1 0.0500 **** 285 H4' -5.2644 -12.1293 7.6576 H 8 A1 0.1000 **** 286 C5' -6.6939 -12.1573 6.0981 C.3 8 A1 -0.1700 **** 287 H5'1 -6.3041 -12.9086 5.4113 H 8 A1 0.1000 **** 288 H5'2 -7.3398 -12.6422 6.8300 H 8 A1 0.1000 **** 289 O4' -4.4470 -11.3005 5.8633 O.3 8 A1 -0.3000 **** 290 N6 -3.1387 -9.4733 -0.3855 N.2 8 A1 -0.6650 **** 291 H61 -2.4037 -9.3839 -1.1016 H 8 A1 0.2800 **** 292 H62 -4.1288 -9.5148 -0.6661 H 8 A1 0.2800 **** 293 C6 -2.8057 -9.5361 0.9145 C.ar 8 A1 0.2150 **** 294 C5 -3.7576 -9.6586 1.9479 C.2 8 A1 0.1400 **** 295 N7 -5.1379 -9.7524 1.9383 N.3 8 A1 -0.2800 **** 296 C8 -5.4512 -9.8476 3.1959 C.2 8 A1 0.1500 **** 297 H8 -6.4788 -9.9284 3.5504 H 8 A1 0.1300 **** 298 N9 -4.3687 -9.8368 4.0331 N.3 8 A1 -0.3900 **** 299 C4 -3.2687 -9.7169 3.2207 C.2 8 A1 0.2800 **** 300 N3 -1.9809 -9.6608 3.6074 N.3 8 A1 -0.2500 **** 301 C2 -1.1961 -9.5410 2.5579 C.ar 8 A1 0.1200 **** 302 H2 -0.1302 -9.4840 2.7782 H 8 A1 0.1000 **** 303 N1 -1.5132 -9.4792 1.2682 N.3 8 A1 -0.2200 **** 304 P -4.6068 -8.2478 8.7728 P 9 T2 1.4000 **** 305 O1P -4.3672 -8.0809 10.2195 O.2 9 T2 -0.8500 **** 306 O2P -5.6709 -7.3960 8.1889 O.2 9 T2 -0.8500 **** 307 O5' -3.2496 -8.0284 7.9653 O.3 9 T2 -0.5000 **** 308 O3' 0.5960 -6.6349 9.0260 O.3 9 T2 -0.5000 **** 309 C1' -0.6623 -6.7222 6.3111 C.3 9 T2 0.2700 **** 310 H1' 0.3209 -6.3352 6.0438 H 9 T2 0.1000 **** 311 C2' -1.2015 -6.0268 7.5543 C.3 9 T2 -0.2000 **** 312 H2'1 -0.7876 -5.0265 7.6810 H 9 T2 0.1000 **** 313 H2'2 -2.2873 -5.9329 7.5375 H 9 T2 0.1000 **** 314 C3' -0.7437 -6.9600 8.6636 C.3 9 T2 0.0500 **** 315 H3' -1.3825 -6.8912 9.5441 H 9 T2 0.1000 **** 316 C4' -0.8478 -8.3379 8.0134 C.3 9 T2 0.0500 **** 317 H4' -0.1232 -8.9801 8.5138 H 9 T2 0.1000 **** 318 C5' -2.1957 -9.0162 8.0899 C.3 9 T2 -0.0500 **** 319 H5'1 -2.2761 -9.7447 7.2831 H 9 T2 0.1000 **** 320 H5'2 -2.2838 -9.5306 9.0468 H 9 T2 0.1000 **** 321 O4' -0.5237 -8.0984 6.6068 O.3 9 T2 -0.3000 **** 322 O4 -3.8465 -6.2573 1.8299 O.2 9 T2 -0.3800 **** 323 C4 -3.1776 -6.3657 2.8643 C.2 9 T2 0.3800 **** 324 N3 -1.8032 -6.3303 2.8217 N.am 9 T2 -0.2800 **** 325 H3 -1.3725 -6.2114 1.8937 H 9 T2 0.2800 **** 326 C2 -0.9415 -6.4378 3.8956 C.2 9 T2 0.3800 **** 327 O2 0.2680 -6.3928 3.7602 O.2 9 T2 -0.3800 **** 328 N1 -1.5497 -6.6002 5.1232 N.am 9 T2 -0.4193 **** 329 C6 -2.9148 -6.6489 5.2606 C.2 9 T2 0.0993 **** 330 H6 -3.3506 -6.7828 6.2507 H 9 T2 0.1000 **** 331 C5 -3.7238 -6.5336 4.1892 C.2 9 T2 -0.1000 **** 332 C5M -5.2193 -6.5857 4.2827 C.3 9 T2 -0.2000 **** 333 H5M1 -5.5174 -6.6191 5.3306 H 9 T2 0.1000 **** 334 H5M2 -5.6444 -5.6990 3.8126 H 9 T2 0.1000 **** 335 H5M3 -5.5849 -7.4771 3.7730 H 9 T2 0.1000 **** 336 P 1.0253 -5.1041 9.1453 P 10 G3 1.4000 **** 337 O1P 2.0673 -4.9574 10.1803 O.2 10 G3 -0.8500 **** 338 O2P -0.1873 -4.2691 9.3225 O.2 10 G3 -0.8500 **** 339 O5' 1.6474 -4.8356 7.7020 O.3 10 G3 -0.5000 **** 340 O3' 5.3690 -1.6026 6.3992 O.3 10 G3 -0.5000 **** 341 C1' 2.7570 -1.6726 4.9382 C.3 10 G3 0.1600 **** 342 H1' 3.3920 -1.2560 4.1564 H 10 G3 0.1000 **** 343 C2' 3.0439 -1.0139 6.2813 C.3 10 G3 -0.2000 **** 344 H2'1 3.4433 -0.0058 6.1705 H 10 G3 0.1000 **** 345 H2'2 2.1543 -0.9473 6.9075 H 10 G3 0.1000 **** 346 C3' 4.0751 -1.9550 6.8826 C.3 10 G3 0.0500 **** 347 H3' 4.0745 -1.9185 7.9719 H 10 G3 0.1000 **** 348 C4' 3.6227 -3.3231 6.3767 C.3 10 G3 0.0500 **** 349 H4' 4.5094 -3.9557 6.3374 H 10 G3 0.1000 **** 350 C5' 2.5833 -5.7983 7.1551 C.3 10 G3 -0.0500 **** 351 H5'1 2.0517 -6.5139 6.5279 H 10 G3 0.1000 **** 352 H5'2 3.0791 -6.3320 7.9659 H 10 G3 0.1000 **** 353 O4' 3.0566 -3.0500 5.0554 O.3 10 G3 -0.3000 **** 354 N2 1.6829 -0.9043 -0.1684 N.2 10 G3 -0.7593 **** 355 H21 2.7119 -0.9378 -0.1973 H 10 G3 0.2800 **** 356 H22 1.1475 -0.7636 -1.0370 H 10 G3 0.2800 **** 357 O6 -2.4092 -1.0300 1.8883 O.2 10 G3 -0.3800 **** 358 C6 -1.1915 -1.1045 2.0521 C.2 10 G3 0.3800 **** 359 C5 -0.4639 -1.3003 3.2477 C.2 10 G3 0.1400 **** 360 N7 -0.9127 -1.4618 4.5603 N.3 10 G3 -0.2800 **** 361 C8 0.1862 -1.6076 5.2547 C.2 10 G3 0.1500 **** 362 H8 0.1896 -1.7598 6.3340 H 10 G3 0.1300 **** 363 N9 1.3401 -1.5517 4.5013 N.3 10 G3 -0.3900 **** 364 C4 0.9178 -1.3553 3.2055 C.2 10 G3 0.3393 **** 365 N3 1.7273 -1.2354 2.1204 N.3 10 G3 -0.4993 **** 366 C2 1.0422 -1.0435 0.9964 C.2 10 G3 0.6986 **** 367 N1 -0.3354 -0.9858 0.9433 N.am 10 G3 -0.4793 **** 368 H1 -0.7700 -0.8449 0.0202 H 10 G3 0.2800 **** 369 P 5.7713 -0.0638 6.2893 P 11 C4 1.4000 **** 370 O1P 7.2210 0.0906 6.5197 O.2 11 C4 -0.8500 **** 371 O2P 4.8856 0.7367 7.1689 O.2 11 C4 -0.8500 **** 372 O5' 5.4245 0.2466 4.7643 O.3 11 C4 -0.5000 **** 373 O3' 7.6248 1.8366 1.5260 O.3 11 C4 -0.5000 **** 374 C1' 4.6535 1.7268 1.8744 C.3 11 C4 0.2700 **** 375 H1' 4.7041 2.1735 0.8815 H 11 C4 0.1000 **** 376 C2' 5.6678 2.3681 2.8124 C.3 11 C4 -0.2000 **** 377 H2'1 5.9160 3.3878 2.5182 H 11 C4 0.1000 **** 378 H2'2 5.3150 2.4007 3.8432 H 11 C4 0.1000 **** 379 C3' 6.8649 1.4427 2.6660 C.3 11 C4 0.0500 **** 380 H3' 7.5038 1.4594 3.5489 H 11 C4 0.1000 **** 381 C4' 6.2153 0.0730 2.4815 C.3 11 C4 0.0500 **** 382 H4' 6.9162 -0.5360 1.9106 H 11 C4 0.1000 **** 383 C5' 5.8703 -0.6819 3.7440 C.3 11 C4 -0.0500 **** 384 H5'1 5.0789 -1.3993 3.5272 H 11 C4 0.1000 **** 385 H5'2 6.7531 -1.2175 4.0934 H 11 C4 0.1000 **** 386 O4' 4.9785 0.3555 1.7526 O.3 11 C4 -0.3000 **** 387 N4 -0.6189 2.0932 3.4792 N.2 11 C4 -0.7593 **** 388 H41 -0.8864 1.9997 4.4695 H 11 C4 0.2800 **** 389 H42 -1.3415 2.2577 2.7639 H 11 C4 0.2800 **** 390 C4 0.6535 2.0020 3.1260 C.2 11 C4 0.4993 **** 391 N3 0.9634 2.1286 1.8299 N.3 11 C4 -0.3362 **** 392 C2 2.2499 2.0388 1.4103 C.2 11 C4 0.4162 **** 393 O2 2.5669 2.1519 0.2198 O.2 11 C4 -0.3800 **** 394 N1 3.2490 1.8195 2.3559 N.am 11 C4 -0.4193 **** 395 C6 2.9446 1.6920 3.6726 C.2 11 C4 0.0993 **** 396 H6 3.7455 1.5146 4.3902 H 11 C4 0.1000 **** 397 C5 1.6614 1.7809 4.1159 C.2 11 C4 -0.1000 **** 398 H5 1.4139 1.6883 5.1734 H 11 C4 0.1000 **** 399 P 7.8705 3.3870 1.2466 P 12 A5 1.4000 **** 400 O1P 9.1776 3.5739 0.5870 O.2 12 A5 -0.8500 **** 401 O2P 7.6623 4.1486 2.5018 O.2 12 A5 -0.8500 **** 402 O5' 6.6911 3.7160 0.2253 O.3 12 A5 -0.5000 **** 403 O3' 6.5544 5.4200 -3.6391 O.3 12 A5 -0.5000 **** 404 C1' 4.3553 5.2283 -1.6169 C.3 12 A5 0.1600 **** 405 H1' 3.8088 5.6941 -2.4368 H 12 A5 0.1000 **** 406 C2' 5.7207 5.8781 -1.4341 C.3 12 A5 -0.2000 **** 407 H2'1 5.7387 6.9090 -1.7876 H 12 A5 0.1000 **** 408 H2'2 6.0401 5.8830 -0.3920 H 12 A5 0.1000 **** 409 C3' 6.6128 4.9863 -2.2825 C.3 12 A5 0.0500 **** 410 H3' 7.6482 5.0032 -1.9424 H 12 A5 0.1000 **** 411 C4' 5.9923 3.6040 -2.0911 C.3 12 A5 0.0500 **** 412 H4' 6.2303 3.0235 -2.9824 H 12 A5 0.1000 **** 413 C5' 6.4621 2.8178 -0.8894 C.3 12 A5 -0.0500 **** 414 H5'1 5.7013 2.0846 -0.6217 H 12 A5 0.1000 **** 415 H5'2 7.3870 2.2987 -1.1406 H 12 A5 0.1000 **** 416 O4' 4.5604 3.8682 -1.9468 O.3 12 A5 -0.3000 **** 417 N6 -0.0745 5.6156 2.4763 N.2 12 A5 -0.6650 **** 418 H61 -1.0838 5.7497 2.6316 H 12 A5 0.2800 **** 419 H62 0.5560 5.4755 3.2786 H 12 A5 0.2800 **** 420 C6 0.4197 5.6231 1.2270 C.ar 12 A5 0.2150 **** 421 C5 1.7890 5.4459 0.9398 C.2 12 A5 0.1400 **** 422 N7 2.8907 5.2265 1.7474 N.3 12 A5 -0.2800 **** 423 C8 3.8791 5.1415 0.9078 C.2 12 A5 0.1500 **** 424 H8 4.9117 4.9783 1.2163 H 12 A5 0.1300 **** 425 N9 3.5004 5.2765 -0.4003 N.3 12 A5 -0.3900 **** 426 C4 2.1418 5.4713 -0.3783 C.2 12 A5 0.2800 **** 427 N3 1.3347 5.6562 -1.4393 N.3 12 A5 -0.2500 **** 428 C2 0.0905 5.8150 -1.0416 C.ar 12 A5 0.1200 **** 429 H2 -0.6358 5.9755 -1.8383 H 12 A5 0.1000 **** 430 N1 -0.4104 5.8083 0.1900 N.3 12 A5 -0.2200 **** 431 P 6.5738 6.9809 -3.9635 P 13 T6 1.4000 **** 432 O1P 7.2424 7.2130 -5.2587 O.2 13 T6 -0.3500 **** 433 O2P 7.1348 7.7141 -2.8031 O.2 13 T6 -0.3500 **** 434 O5' 5.0162 7.2984 -4.0881 O.3 13 T6 -0.5000 **** 435 O3' 2.6165 9.0696 -7.0877 O.3 13 T6 -0.3800 **** 436 HO3' 3.1809 9.2556 -7.9289 H 13 T6 0.3500 **** 437 C1' 2.0289 8.7839 -4.1633 C.3 13 T6 0.2700 **** 438 H1' 1.1004 9.2505 -4.4922 H 13 T6 0.1000 **** 439 C2' 3.2348 9.4648 -4.7973 C.3 13 T6 -0.2000 **** 440 H2'1 3.0315 10.5020 -5.0634 H 13 T6 0.1000 **** 441 H2'2 4.1053 9.4589 -4.1414 H 13 T6 0.1000 **** 442 C3' 3.4674 8.6115 -6.0337 C.3 13 T6 -0.0700 **** 443 H3' 4.5050 8.6486 -6.3656 H 13 T6 0.1000 **** 444 C4' 3.0914 7.2107 -5.5557 C.3 13 T6 0.0500 **** 445 H4' 2.7664 6.6527 -6.4338 H 13 T6 0.1000 **** 446 C5' 4.1851 6.4150 -4.8823 C.3 13 T6 -0.0500 **** 447 H5'1 3.7339 5.6579 -4.2410 H 13 T6 0.1000 **** 448 H5'2 4.7913 5.9242 -5.6436 H 13 T6 0.1000 **** 449 O4' 2.0146 7.4357 -4.5909 O.3 13 T6 -0.3000 **** 450 O4 1.9808 8.8198 1.3533 O.2 13 T6 -0.3800 **** 451 C4 2.0451 8.8043 0.1184 C.2 13 T6 0.3800 **** 452 N3 0.9141 8.9636 -0.6482 N.am 13 T6 -0.2800 **** 453 H3 0.0268 9.0929 -0.1415 H 13 T6 0.2800 **** 454 C2 0.8464 8.9679 -2.0276 C.2 13 T6 0.3800 **** 455 O2 -0.2058 9.1187 -2.6221 O.2 13 T6 -0.3800 **** 456 N1 2.0509 8.7882 -2.6758 N.am 13 T6 -0.4193 **** 457 C6 3.2295 8.6195 -1.9922 C.2 13 T6 0.0993 **** 458 H6 4.1567 8.4768 -2.5472 H 13 T6 0.1000 **** 459 C5 3.2566 8.6279 -0.6450 C.2 13 T6 -0.1000 **** 460 C5M 4.5142 8.4426 0.1500 C.3 13 T6 -0.2000 **** 461 H5M1 5.3701 8.4142 -0.5243 H 13 T6 0.1000 **** 462 H5M2 4.6293 9.2722 0.8476 H 13 T6 0.1000 **** 463 H5M3 4.4589 7.5065 0.7056 H 13 T6 0.1000 **** @BOND 1 1 2 1 2 1 13 1 3 3 9 1 4 3 31 1 5 4 16 1 6 4 5 1 7 4 6 1 8 4 25 1 9 6 9 1 10 6 7 1 11 6 8 1 12 9 11 1 13 9 10 1 14 11 13 1 15 11 12 1 16 11 16 1 17 13 14 1 18 13 15 1 19 17 20 1 20 17 18 1 21 17 19 1 22 20 21 1 23 20 30 2 24 21 26 2 25 21 22 1 26 22 23 2 27 23 25 1 28 23 24 1 29 25 26 1 30 26 27 1 31 27 28 2 32 28 30 1 33 28 29 1 34 31 32 ar 35 31 33 ar 36 31 34 1 37 34 45 1 38 35 41 1 39 35 63 1 40 36 48 1 41 36 37 1 42 36 38 1 43 36 55 1 44 38 41 1 45 38 39 1 46 38 40 1 47 41 43 1 48 41 42 1 49 43 45 1 50 43 44 1 51 43 48 1 52 45 46 1 53 45 47 1 54 49 50 2 55 50 51 1 56 50 58 1 57 51 53 1 58 51 52 1 59 53 55 1 60 53 54 2 61 55 56 1 62 56 58 2 63 56 57 1 64 58 59 1 65 59 60 1 66 59 61 1 67 59 62 1 68 63 64 ar 69 63 65 ar 70 63 66 1 71 66 77 1 72 67 73 1 73 67 95 1 74 68 80 1 75 68 69 1 76 68 70 1 77 68 89 1 78 70 73 1 79 70 71 1 80 70 72 1 81 73 75 1 82 73 74 1 83 75 77 1 84 75 76 1 85 75 80 1 86 77 78 1 87 77 79 1 88 81 92 1 89 81 242 1 90 81 82 1 91 83 84 2 92 84 85 1 93 84 93 1 94 85 90 2 95 85 86 1 96 86 87 2 97 87 89 1 98 87 88 1 99 89 90 1 100 90 91 1 101 91 92 2 102 92 93 1 103 93 94 1 104 95 96 ar 105 95 97 ar 106 95 98 1 107 98 109 1 108 99 105 1 109 99 125 1 110 100 112 1 111 100 101 1 112 100 102 1 113 100 120 1 114 102 105 1 115 102 103 1 116 102 104 1 117 105 107 1 118 105 106 1 119 107 109 1 120 107 108 1 121 107 112 1 122 109 110 1 123 109 111 1 124 113 116 1 125 113 114 1 126 113 115 1 127 116 117 2 128 116 123 1 129 117 118 1 130 118 120 1 131 118 119 2 132 120 121 1 133 121 123 2 134 121 122 1 135 123 124 1 136 125 126 ar 137 125 127 ar 138 125 128 1 139 128 139 1 140 129 135 1 141 129 157 1 142 130 142 1 143 130 131 1 144 130 132 1 145 130 151 1 146 132 135 1 147 132 133 1 148 132 134 1 149 135 137 1 150 135 136 1 151 137 139 1 152 137 138 1 153 137 142 1 154 139 140 1 155 139 141 1 156 143 146 1 157 143 144 1 158 143 145 1 159 146 147 1 160 146 156 2 161 147 152 2 162 147 148 1 163 148 149 2 164 149 151 1 165 149 150 1 166 151 152 1 167 152 153 1 168 153 154 2 169 154 156 1 170 154 155 1 171 157 158 1 172 157 159 1 173 157 160 1 174 160 172 1 175 161 162 1 176 161 168 1 177 163 164 1 178 163 165 1 179 163 175 1 180 163 182 1 181 165 166 1 182 165 167 1 183 165 168 1 184 168 169 1 185 168 170 1 186 170 171 1 187 170 172 1 188 170 175 1 189 172 173 1 190 172 174 1 191 176 177 2 192 177 178 1 193 177 185 1 194 178 179 1 195 178 180 1 196 180 181 2 197 180 182 1 198 182 183 1 199 183 185 2 200 183 184 1 201 185 186 1 202 186 187 1 203 186 188 1 204 186 189 1 205 190 192 1 206 190 198 2 207 190 191 1 208 192 194 2 209 192 193 1 210 194 196 1 211 194 195 1 212 196 197 2 213 196 229 1 214 197 198 1 215 197 199 1 216 198 203 1 217 199 200 2 218 199 201 1 219 201 202 2 220 201 205 1 221 202 203 1 222 202 210 1 223 203 204 2 224 205 206 1 225 205 208 2 226 206 207 1 227 208 209 1 228 208 211 1 229 209 210 2 230 209 226 1 231 210 231 1 232 211 212 1 233 211 213 1 234 211 214 1 235 212 233 1 236 214 215 1 237 214 216 1 238 214 217 1 239 217 218 1 240 217 220 1 241 217 226 1 242 218 219 1 243 220 221 2 244 220 222 1 245 222 223 1 246 222 224 1 247 222 225 1 248 226 227 1 249 226 228 1 250 229 230 1 251 231 232 1 252 233 234 1 253 233 235 1 254 233 273 1 255 235 236 1 256 235 237 1 257 235 238 1 258 238 239 1 259 238 240 1 260 238 250 1 261 240 241 1 262 240 242 1 263 242 244 1 264 242 243 1 265 244 245 1 266 244 249 1 267 244 254 1 268 245 246 1 269 245 247 1 270 245 248 1 271 250 251 1 272 250 252 1 273 250 267 1 274 252 253 1 275 253 254 1 276 253 255 1 277 253 256 1 278 256 257 1 279 256 258 1 280 256 266 1 281 258 259 1 282 258 263 1 283 258 264 1 284 259 260 1 285 259 261 1 286 259 262 1 287 264 265 1 288 267 268 1 289 267 272 1 290 267 273 1 291 268 269 1 292 268 270 1 293 268 271 1 294 274 275 1 295 274 286 1 296 276 282 1 297 276 304 1 298 277 289 1 299 277 278 1 300 277 279 1 301 277 298 1 302 279 282 1 303 279 280 1 304 279 281 1 305 282 284 1 306 282 283 1 307 284 286 1 308 284 285 1 309 284 289 1 310 286 287 1 311 286 288 1 312 290 293 1 313 290 291 1 314 290 292 1 315 293 294 1 316 293 303 2 317 294 299 2 318 294 295 1 319 295 296 2 320 296 298 1 321 296 297 1 322 298 299 1 323 299 300 1 324 300 301 2 325 301 303 1 326 301 302 1 327 304 305 ar 328 304 306 ar 329 304 307 1 330 307 318 1 331 308 314 1 332 308 336 1 333 309 321 1 334 309 310 1 335 309 311 1 336 309 328 1 337 311 314 1 338 311 312 1 339 311 313 1 340 314 316 1 341 314 315 1 342 316 318 1 343 316 317 1 344 316 321 1 345 318 319 1 346 318 320 1 347 322 323 2 348 323 324 1 349 323 331 1 350 324 326 1 351 324 325 1 352 326 328 1 353 326 327 2 354 328 329 1 355 329 331 2 356 329 330 1 357 331 332 1 358 332 333 1 359 332 334 1 360 332 335 1 361 336 337 ar 362 336 338 ar 363 336 339 1 364 339 350 1 365 340 346 1 366 340 369 1 367 341 353 1 368 341 342 1 369 341 343 1 370 341 363 1 371 343 346 1 372 343 344 1 373 343 345 1 374 346 348 1 375 346 347 1 376 348 350 1 377 348 349 1 378 348 353 1 379 350 351 1 380 350 352 1 381 354 366 1 382 354 355 1 383 354 356 1 384 357 358 2 385 358 359 1 386 358 367 1 387 359 364 2 388 359 360 1 389 360 361 2 390 361 363 1 391 361 362 1 392 363 364 1 393 364 365 1 394 365 366 2 395 366 367 1 396 367 368 1 397 369 370 ar 398 369 371 ar 399 369 372 1 400 372 383 1 401 373 379 1 402 373 399 1 403 374 386 1 404 374 375 1 405 374 376 1 406 374 394 1 407 376 379 1 408 376 377 1 409 376 378 1 410 379 381 1 411 379 380 1 412 381 383 1 413 381 382 1 414 381 386 1 415 383 384 1 416 383 385 1 417 387 390 1 418 387 388 1 419 387 389 1 420 390 391 2 421 390 397 1 422 391 392 1 423 392 394 1 424 392 393 2 425 394 395 1 426 395 397 2 427 395 396 1 428 397 398 1 429 399 400 ar 430 399 401 ar 431 399 402 1 432 402 413 1 433 403 409 1 434 403 431 1 435 404 416 1 436 404 405 1 437 404 406 1 438 404 425 1 439 406 409 1 440 406 407 1 441 406 408 1 442 409 411 1 443 409 410 1 444 411 413 1 445 411 412 1 446 411 416 1 447 413 414 1 448 413 415 1 449 417 420 1 450 417 418 1 451 417 419 1 452 420 421 1 453 420 430 2 454 421 426 2 455 421 422 1 456 422 423 2 457 423 425 1 458 423 424 1 459 425 426 1 460 426 427 1 461 427 428 2 462 428 430 1 463 428 429 1 464 431 432 1 465 431 433 1 466 431 434 1 467 434 446 1 468 435 436 1 469 435 442 1 470 437 438 1 471 437 439 1 472 437 449 1 473 437 456 1 474 439 440 1 475 439 441 1 476 439 442 1 477 442 443 1 478 442 444 1 479 444 445 1 480 444 446 1 481 444 449 1 482 446 447 1 483 446 448 1 484 450 451 2 485 451 452 1 486 451 459 1 487 452 453 1 488 452 454 1 489 454 455 2 490 454 456 1 491 456 457 1 492 457 459 2 493 457 458 1 494 459 460 1 495 460 461 1 496 460 462 1 497 460 463 1 @SUBSTRUCTURE 1 A1 1 **** 0 **** **** 2 T2 31 **** 0 **** **** 3 G3 63 **** 0 **** **** 4 C4 95 **** 0 **** **** 5 A5 125 **** 0 **** **** 6 T6 157 **** 0 **** **** 7 NPCN1 190 **** 0 **** **** 8 A1 274 **** 0 **** **** 9 T2 304 **** 0 **** **** 10 G3 336 **** 0 **** **** 11 C4 369 **** 0 **** **** 12 A5 399 **** 0 **** **** 13 T6 431 **** 0 **** ****