NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 321 M 4.2705 8.2893 120.3368 55.1526 32.6908 174.8590 322 T 3.9098 8.0942 117.1759 61.1651 69.6572 173.7401 323 D 4.4277 8.8367 120.9099 57.4268 41.7436 180.4861 324 G 3.5852 7.9632 105.8288 47.7014 0.0000 175.4158 325 L 4.0848 8.1213 122.8735 57.6861 42.1639 178.6585 326 N 4.1870 8.0331 116.7631 56.5074 38.8485 176.3733 327 Q 3.9441 8.0251 121.0373 59.3138 29.0963 178.0332 328 L 3.9138 7.9445 121.0328 58.7684 42.0604 178.6149 329 Y 3.9096 8.0867 115.8346 61.2044 37.7754 178.5359 330 N 4.4554 8.2114 117.1290 56.0324 38.6656 177.4781 331 L 3.9432 8.2454 120.8100 57.8469 41.8949 179.6224 332 V 3.6470 7.9082 117.8142 66.0340 31.4327 177.6983 333 A 4.0455 8.0319 120.3357 55.5576 18.1400 179.6702 334 Q 4.0074 8.7786 116.7229 58.9192 28.6544 178.4794 335 D 4.2899 8.2451 119.0985 57.7765 41.3776 178.0182 336 Y 3.8046 8.2419 116.6255 60.7609 37.7866 178.4602 337 A 4.0520 8.3147 121.7502 55.3133 18.6811 179.4770 338 L 3.9718 8.2579 117.7926 58.4172 41.5552 180.1629 339 T 3.8767 7.6678 115.0911 66.7055 68.3516 176.4174 340 D 4.4113 8.1833 120.7860 57.9753 40.8749 179.2533 341 T 3.9246 8.3842 116.4335 66.4420 68.1532 176.9329 342 I 3.7102 7.4234 120.6589 64.4566 37.5359 177.6329 343 E 4.1567 8.4788 119.4748 59.7174 29.3842 179.3357 344 A 4.0437 8.3117 120.5934 55.5004 18.4192 179.6937 345 L 4.1218 8.0652 117.1977 58.0091 41.5830 180.0193 346 S 3.5672 8.2254 115.2263 61.5699 62.7646 176.9480 347 R 3.9208 7.9243 120.2110 59.5299 29.8510 178.9068 348 M 4.2401 8.1673 118.5561 57.9738 31.9350 178.6731 349 L 4.3626 7.6974 122.1287 57.8382 42.0670 178.4043 350 H 4.1326 8.0617 117.0376 59.3349 29.9723 176.8817 351 R 4.1075 8.2068 116.9599 56.5202 30.0371 177.6811 352 G 3.9681 7.7649 107.2584 45.6507 0.0000 174.9259 353 T 4.0338 7.8669 117.0942 65.6977 68.7492 174.6712 354 I 4.6869 7.3530 112.8670 57.5229 40.9483 172.9809 355 P 4.8149 0.0000 0.0000 61.7572 33.6712 177.0741 356 L 4.0016 8.3947 119.3915 58.5665 41.9599 178.5143 357 D 4.3910 8.2176 118.3948 56.9112 39.0755 178.6936 358 T 3.8547 7.8693 116.4993 66.3100 68.5861 176.1544 359 F 4.1112 8.1507 122.3735 61.3444 39.3757 177.1776 360 V 3.3858 8.1443 117.9581 65.8255 31.4138 177.7784 361 K 3.8402 7.9135 119.0832 59.6634 32.0874 178.7193 362 Q 4.0116 8.0950 118.2547 58.8482 28.5888 179.0385 363 G 3.2006 8.1304 106.8956 47.6768 0.0000 175.6531 364 R 3.8284 7.8040 120.8379 58.8806 30.0425 178.5574 365 E 3.8559 7.8832 118.4342 59.5117 29.6152 178.8738 366 L 3.9429 8.0135 118.6281 57.7307 41.6419 179.5009 367 A 3.9757 8.3114 121.1269 55.0121 18.3669 179.6269 368 R 3.8465 8.4285 117.6723 59.7829 30.2060 178.7321 369 Q 4.0691 8.3611 118.0402 58.9556 28.5774 178.6548 370 Q 3.9775 8.2371 120.6717 59.1285 29.0821 178.0401 371 F 4.1001 8.3137 121.6336 61.3961 39.4131 177.0098 372 L 4.0751 8.0175 118.0547 57.7598 41.4340 179.7229 373 V 3.6011 7.9312 118.0102 66.1236 31.5653 178.2197 374 R 3.8668 8.1331 117.9838 59.0642 29.9146 178.8081 375 W 3.9508 8.1769 128.4495 60.5696 30.5765 177.3265 376 H 3.9647 8.3159 118.1544 59.4262 29.2693 177.1852 377 I 3.6150 7.7096 121.4354 64.5516 36.6776 178.4199 378 Q 3.8783 7.6503 117.7567 58.8708 28.5329 178.8335 379 R 3.7450 7.2166 118.1534 59.0320 29.9197 178.8742 380 I 3.8512 7.5212 119.7458 64.4776 36.8938 178.0327 381 T 4.3421 7.5927 108.0055 61.1636 69.2057 174.5115 382 S 4.5905 6.7803 115.7156 56.6510 65.2730 172.9723 383 P 4.3419 0.0000 0.0000 68.1573 29.3894 179.7986 384 L 3.3623 7.5312 114.8505 56.9471 38.2256 176.3571 385 S 4.2967 7.9621 120.6504 58.7594 63.1346 169.9451 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 321 M 8.29 4.27 0.00 1.87 1.94 0.00 0.00 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 322 T 8.09 3.91 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 323 D 8.84 4.43 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 324 G 7.96 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 325 L 8.12 4.08 0.00 1.79 1.65 1.03 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 326 N 8.03 4.19 0.00 3.04 2.78 0.00 0.00 6.76 6.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 327 Q 8.03 3.94 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.50 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 328 L 7.94 3.91 0.00 1.95 1.99 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 329 Y 8.09 3.91 0.00 3.22 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 330 N 8.21 4.46 0.00 3.03 2.89 0.00 0.00 7.02 6.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 331 L 8.25 3.94 0.00 1.80 1.68 0.67 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 332 V 7.91 3.65 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.93 0.00 0.00 333 A 8.03 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 334 Q 8.78 4.01 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 335 D 8.25 4.29 0.00 2.73 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 336 Y 8.24 3.80 0.00 3.17 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 337 A 8.31 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 338 L 8.26 3.97 0.00 1.93 1.75 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 339 T 7.67 3.88 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 340 D 8.18 4.41 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 341 T 8.38 3.92 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 342 I 7.42 3.71 2.08 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.68 1.00 0.00 0.00 343 E 8.48 4.16 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 344 A 8.31 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 345 L 8.07 4.12 0.00 2.31 2.28 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 346 S 8.23 3.57 0.00 4.04 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 347 R 7.92 3.92 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.88 0.00 348 M 8.17 4.24 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 349 L 7.70 4.36 0.00 1.58 1.63 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 350 H 8.06 4.13 0.00 3.06 3.46 0.00 6.00 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 351 R 8.21 4.11 0.00 1.83 1.94 0.00 3.26 0.00 0.00 3.23 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 352 G 7.76 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 353 T 7.87 4.03 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 354 I 7.35 4.69 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.97 0.95 0.00 0.00 355 P 0.00 4.81 0.00 2.47 2.24 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 356 L 8.39 4.00 0.00 1.80 1.74 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 357 D 8.22 4.39 0.00 2.92 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 358 T 7.87 3.85 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 359 F 8.15 4.11 0.00 3.20 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 360 V 8.14 3.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.14 0.00 0.00 361 K 7.91 3.84 0.00 1.86 1.75 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.45 7.81 362 Q 8.10 4.01 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 363 G 8.13 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 364 R 7.80 3.83 0.00 2.04 1.94 0.00 3.25 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 365 E 7.88 3.86 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 366 L 8.01 3.94 0.00 1.81 1.69 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 367 A 8.31 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 368 R 8.43 3.85 0.00 1.92 2.11 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 369 Q 8.36 4.07 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 370 Q 8.24 3.98 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 371 F 8.31 4.10 0.00 3.14 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 372 L 8.02 4.08 0.00 2.16 1.80 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 373 V 7.93 3.60 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.05 0.00 0.00 374 R 8.13 3.87 0.00 1.88 1.89 0.00 3.19 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 375 W 8.18 3.95 0.00 2.62 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 376 H 8.32 3.96 0.00 3.49 3.50 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 377 I 7.71 3.62 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.55 0.86 0.00 0.00 378 Q 7.65 3.88 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 379 R 7.22 3.75 0.00 1.62 1.64 0.00 2.21 0.00 0.00 2.64 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 380 I 7.52 3.85 1.96 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.99 0.87 0.00 0.00 381 T 7.59 4.34 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 382 S 6.78 4.59 0.00 3.93 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 383 P 0.00 4.34 0.00 2.18 2.13 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 384 L 7.53 3.36 0.00 1.71 2.00 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 385 S 7.96 4.30 0.00 4.03 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00