NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 353 M 4.3775 8.3049 120.3486 54.2971 33.4919 176.2193 354 K 3.8254 8.7752 114.9279 53.4216 33.9527 174.0285 355 P 4.4041 0.0000 0.0000 62.6370 32.9650 174.9197 356 E 4.4634 8.5055 120.7764 54.6029 30.7107 175.1607 357 K 4.5160 8.5113 125.5988 54.7726 33.9240 175.6156 358 I 4.4716 8.0227 124.0274 59.7860 39.0888 175.4662 359 D 4.7154 8.4823 124.9835 54.1868 41.0055 174.8047 360 C 4.7523 7.7719 116.3632 57.8021 35.3665 172.2549 361 N 4.9690 8.4759 121.4085 51.6169 38.9340 175.0579 362 F 4.3025 9.2803 126.1114 60.5488 39.2540 177.7340 363 K 4.4157 7.8635 117.6448 58.0621 32.1585 178.1637 364 L 4.1638 8.0785 119.6499 57.1719 42.0619 178.1142 365 I 4.1847 7.3867 109.1679 60.8249 38.3225 174.6739 366 Y 5.4955 8.0309 118.5496 56.9946 42.2552 174.8802 367 C 4.4245 8.6548 122.2191 59.1625 32.3123 175.7094 368 E 3.8724 9.0521 125.2949 58.8549 29.0514 176.4235 *377 L 4.0164 7.7387 121.5510 55.3761 43.3600 174.7243 378 E 5.0356 8.6648 127.2839 54.7440 31.0590 174.8325 379 F 4.9666 8.8925 125.1212 55.4755 42.8431 175.6444 380 S 4.3396 9.3072 118.3201 57.3452 64.3004 175.2104 381 L 3.9887 8.3035 119.8323 57.7164 41.1815 179.4822 382 E 3.9958 8.0952 117.2388 59.2156 29.7018 178.9332 383 E 4.0127 7.9072 119.7694 59.0610 29.5149 179.3128 384 V 3.3330 7.6642 118.3569 65.7892 31.3307 177.7892 385 L 3.8820 7.9849 119.9114 58.1597 41.9327 178.7259 386 A 4.0998 8.4495 121.0392 55.2810 18.2136 179.7778 387 I 3.6943 7.8026 118.2606 64.5387 37.0533 178.5648 388 S 4.2341 8.2006 114.5145 60.4863 62.7284 175.2529 389 R 4.5495 6.7709 118.7395 54.9903 31.6791 175.0540 390 N 4.2148 8.4158 113.6020 54.9294 36.2690 174.7819 391 V 4.4217 8.0040 113.1983 62.3693 33.4933 175.2945 392 Y 4.3979 8.2127 119.0108 59.9140 39.0468 175.1659 393 K 4.5354 7.6140 117.7086 53.9749 34.9207 175.5770 394 R 3.7370 8.4817 121.0796 55.7717 31.1231 176.7792 395 V 3.6241 8.3049 117.3243 63.6357 32.5276 172.7580 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 353 M 8.30 4.38 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.63 0.00 354 K 8.78 3.83 0.00 1.86 1.77 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.49 7.81 355 P 0.00 4.40 0.00 2.16 2.03 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 356 E 8.51 4.46 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 357 K 8.51 4.52 0.00 1.77 1.70 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.42 7.81 358 I 8.02 4.47 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.52 1.18 0.00 0.00 359 D 8.48 4.72 0.00 2.64 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.77 4.75 0.00 3.01 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 0.00 361 N 8.48 4.97 0.00 2.78 2.72 0.00 0.00 6.89 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 362 F 9.28 4.30 0.00 3.19 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 363 K 7.86 4.42 0.00 2.07 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.50 7.81 364 L 8.08 4.16 0.00 1.93 1.64 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 365 I 7.39 4.18 1.44 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.31 0.73 0.00 0.00 366 Y 8.03 5.50 0.00 3.12 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 367 C 8.65 4.42 0.00 3.14 2.75 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 0.00 368 E 9.05 3.87 0.00 2.12 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 0.00 2.36 2.40 0.00 *377 L 7.74 4.02 0.00 1.86 1.73 0.98 0.59 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 0.00 378 E 8.66 5.04 0.00 2.11 1.75 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 2.01 1.98 0.00 379 F 8.89 4.97 0.00 2.82 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 0.00 380 S 9.31 4.34 0.00 3.94 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 0.00 381 L 8.30 3.99 0.00 1.68 1.72 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 382 E 8.10 4.00 0.00 2.18 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 0.00 2.36 2.35 0.00 383 E 7.91 4.01 0.00 2.26 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 2.57 2.39 0.00 384 V 7.66 3.33 2.19 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 0.82 0.00 0.00 0.91 0.00 0.00 385 L 7.98 3.88 0.00 1.90 1.82 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 386 A 8.45 4.10 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 387 I 7.80 3.69 1.84 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.28 0.75 0.00 0.00 388 S 8.20 4.23 0.00 3.99 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 389 R 6.77 4.55 0.00 1.69 1.87 0.00 3.32 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 390 N 8.42 4.21 0.00 2.81 2.87 0.00 0.00 6.55 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 391 V 8.00 4.42 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.00 0.00 0.00 392 Y 8.21 4.40 0.00 2.94 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 0.00 393 K 7.61 4.54 0.00 1.77 1.66 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.48 7.81 394 R 8.48 3.74 0.00 1.77 1.90 0.00 3.32 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 395 V 8.30 3.62 2.08 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 0.71 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.