NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 345 S 4.4149 8.3349 115.3978 58.6603 64.3359 173.4049 346 H 4.4854 8.0344 112.8293 56.7310 29.4762 174.6052 *348 A 4.1383 8.5311 121.6198 51.8455 21.7368 177.6508 349 T 3.7704 8.2980 118.7273 67.0025 68.5402 176.7341 350 R 3.8760 8.0798 119.7792 59.8582 29.8559 178.0376 351 D 4.3021 7.9622 117.9667 56.9875 40.8743 178.1401 352 L 3.8583 7.9113 120.9768 58.1761 42.0377 179.2940 353 V 3.5016 7.8566 118.0428 65.9201 31.4926 177.9085 354 L 3.9322 8.1524 119.0562 57.6968 41.4525 179.3843 355 L 3.7544 8.1805 119.3699 57.8375 41.6044 179.7816 356 G 3.5113 7.9654 105.6097 47.8843 0.0000 175.5044 357 E 4.0197 8.0260 120.6498 59.2344 29.3943 179.2316 358 Q 4.0652 7.9357 118.1034 59.1403 28.7715 178.9957 359 F 4.4893 8.2866 118.7637 60.5781 38.9165 177.7010 360 R 4.0308 8.1723 118.3593 59.4365 29.9274 178.3484 361 E 4.0065 8.3985 118.3396 59.6197 29.5477 179.1631 362 E 4.0120 8.5316 118.6795 59.6851 29.5675 178.7874 363 Y 4.0827 8.5966 119.8768 60.7652 38.9389 178.4175 364 K 3.9668 8.2802 119.3787 59.2625 32.0078 179.4323 365 L 3.9764 7.8036 119.2027 57.9907 41.5542 179.6320 366 T 3.7851 7.8723 109.7001 64.7855 68.3603 176.6204 367 Q 3.7507 7.5512 120.2461 58.4978 28.7148 177.9076 368 E 4.0175 7.7526 119.2433 59.1599 29.9707 178.2935 369 L 4.1673 8.0199 119.2428 57.9801 41.6810 180.3113 370 E 4.1845 8.0250 114.7445 57.2156 29.0836 178.8004 *372 L 4.2785 7.8952 121.6623 55.2126 43.9637 179.4678 373 T 3.9297 8.0677 115.3238 66.4648 68.2644 176.7035 374 D 4.3714 8.2684 121.0707 57.4220 40.7475 179.0165 375 R 3.9372 7.9023 118.1576 58.9721 30.1323 178.5981 376 L 3.9148 8.0998 120.3470 58.3269 42.2170 178.9421 377 Q 3.9982 8.1390 119.4080 58.9692 29.0718 178.0107 378 L 4.0240 8.0860 120.2765 58.0866 41.5677 179.6168 379 T 3.9541 8.2770 116.0369 66.4100 68.3229 176.9134 380 L 3.9787 8.0850 121.0657 57.7394 41.5693 179.6224 381 R 3.8967 7.9272 117.4833 59.3226 30.0042 178.9192 382 A 3.9714 7.8859 120.1200 55.1002 18.3081 179.4452 383 L 3.8813 8.1179 119.0263 58.1553 42.1713 178.7451 384 E 3.9212 8.6251 119.7519 59.4411 29.5892 178.6152 385 D 4.3376 8.3347 119.0311 57.1793 40.8253 178.2848 386 E 3.8921 8.3410 119.8669 59.3496 29.6792 179.0197 387 K 3.9543 8.2032 118.4871 59.4461 32.0978 179.3333 388 K 3.9847 8.0308 118.6498 59.6008 31.9713 179.4824 389 K 4.0257 8.0761 118.5485 59.7334 31.9263 179.6076 390 T 3.8727 8.0893 116.1818 66.5016 68.4495 176.3343 391 D 4.4058 8.5475 121.2682 57.8753 40.9697 178.8442 392 T 3.9696 7.8882 115.9980 66.7362 68.2711 176.0709 393 L 3.8975 7.5856 120.4107 58.0946 42.1533 178.2747 394 L 3.9014 7.6074 119.9915 58.6133 41.9531 178.7424 395 Y 4.2216 7.4374 116.1316 60.8108 37.6108 178.2062 396 S 4.2860 8.1989 114.2523 60.4933 63.1737 175.6372 397 V 4.0384 7.2840 119.6515 62.1173 32.0342 175.1359 398 L 4.6539 6.9626 117.7310 52.6610 43.5088 174.4829 399 P 4.1568 0.0000 0.0000 62.9754 31.5351 175.6264 400 P 4.3281 0.0000 0.0000 64.5439 31.7939 177.2967 401 S 4.6064 8.2548 113.3392 59.6522 64.3951 176.4591 402 V 3.5912 7.7187 121.0138 65.6491 31.4968 177.7488 403 A 4.2215 7.9925 120.1656 55.2475 18.1635 178.9745 404 N 4.3374 8.0166 113.9167 56.2202 39.0750 176.4337 405 E 4.0614 7.8219 120.4201 59.3168 29.9315 178.1452 406 L 4.1446 7.4813 117.6578 57.7905 41.7483 177.5390 407 R 3.9849 7.3019 120.1398 56.3336 30.0199 176.1514 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 345 S 8.33 4.41 0.00 3.96 3.98 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 0.00 346 H 8.03 4.49 0.00 3.25 3.34 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *348 A 8.53 4.14 1.28 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 0.00 349 T 8.30 3.77 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 1.19 0.00 0.00 350 R 8.08 3.88 0.00 1.85 1.93 0.00 3.16 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 351 D 7.96 4.30 0.00 2.86 2.66 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 0.00 352 L 7.91 3.86 0.00 1.69 1.81 0.90 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 353 V 7.86 3.50 2.20 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 0.94 0.00 0.00 0.92 0.00 0.00 354 L 8.15 3.93 0.00 1.81 1.66 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 355 L 8.18 3.75 0.00 1.70 1.10 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 356 G 7.97 3.51 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 0.00 357 E 8.03 4.02 0.00 2.14 1.99 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 2.49 2.47 0.00 358 Q 7.94 4.07 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 359 F 8.29 4.49 0.00 3.15 3.01 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 R 8.17 4.03 0.00 2.11 2.20 0.00 3.24 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 361 E 8.40 4.01 0.00 2.26 2.03 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 2.54 2.53 0.00 362 E 8.53 4.01 0.00 2.26 2.05 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 2.39 2.61 0.00 363 Y 8.60 4.08 0.00 3.18 3.18 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 K 8.28 3.97 0.00 2.05 1.85 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.73 7.81 365 L 7.80 3.98 0.00 1.84 1.69 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 366 T 7.87 3.79 4.14 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 0.00 367 Q 7.55 3.75 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.99 0.00 0.00 0.00 0.00 0.00 1.57 2.11 0.00 368 E 7.75 4.02 0.00 2.07 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 2.30 2.32 0.00 369 L 8.02 4.17 0.00 1.86 1.68 0.89 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 370 E 8.02 4.18 0.00 2.09 1.92 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 2.41 0.00 *372 L 7.90 4.28 0.00 1.85 1.74 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 373 T 8.07 3.93 4.22 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 0.00 0.00 0.00 1.20 0.00 0.00 374 D 8.27 4.37 0.00 2.68 2.70 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 0.00 375 R 7.90 3.94 0.00 2.00 1.97 0.00 3.13 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 376 L 8.10 3.91 0.00 1.98 1.84 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 377 Q 8.14 4.00 0.00 2.34 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 378 L 8.09 4.02 0.00 2.04 1.70 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 379 T 8.28 3.95 4.24 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 0.00 0.00 0.00 1.21 0.00 0.00 380 L 8.08 3.98 0.00 1.86 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 381 R 7.93 3.90 0.00 1.98 1.98 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.80 0.00 382 A 7.89 3.97 1.40 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 0.00 383 L 8.12 3.88 0.00 1.85 1.85 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 384 E 8.63 3.92 0.00 2.04 2.14 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 2.31 2.36 0.00 385 D 8.33 4.34 0.00 2.88 2.70 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 0.00 386 E 8.34 3.89 0.00 2.28 2.05 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 2.31 2.40 0.00 387 K 8.20 3.95 0.00 1.85 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 388 K 8.03 3.98 0.00 2.08 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.51 7.81 389 K 8.08 4.03 0.00 2.03 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.55 7.81 390 T 8.09 3.87 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 1.18 0.00 0.00 391 D 8.55 4.41 0.00 2.92 2.92 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 0.00 392 T 7.89 3.97 4.45 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 1.24 0.00 0.00 393 L 7.59 3.90 0.00 1.74 1.88 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 394 L 7.61 3.90 0.00 1.53 1.07 0.73 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 395 Y 7.44 4.22 0.00 3.14 2.99 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 0.00 396 S 8.20 4.29 0.00 4.06 4.19 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 0.00 397 V 7.28 4.04 2.16 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 0.85 0.00 0.00 0.94 0.00 0.00 398 L 6.96 4.65 0.00 1.89 1.61 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 399 P 0.00 4.16 0.00 2.18 2.03 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 400 P 0.00 4.33 0.00 2.02 2.14 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 401 S 8.25 4.61 0.00 4.00 4.07 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 0.00 402 V 7.72 3.59 2.11 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 0.95 0.00 0.00 403 A 7.99 4.22 1.52 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 0.00 404 N 8.02 4.34 0.00 2.89 2.96 0.00 0.00 6.91 7.65 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 0.00 405 E 7.82 4.06 0.00 2.17 2.13 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 2.33 2.35 0.00 406 L 7.48 4.14 0.00 1.95 1.93 1.11 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 407 R 7.30 3.98 0.00 1.69 1.66 0.00 2.79 0.00 0.00 2.98 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.79 0.00 * Residues marked with a * may have inaccurate shift predictions.