NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 347 G 3.8365 8.3544 109.7252 45.2043 0.0000 172.6686 348 S 4.1921 8.2643 113.6500 57.8396 63.1713 173.0069 349 H 4.3802 8.8880 126.3678 55.5358 29.0976 175.3489 *351 A 4.1190 7.7095 120.7391 52.3138 19.9136 176.1120 352 Y 5.2135 8.5572 120.2145 56.5839 41.2941 174.8667 353 T 5.0389 8.8895 111.1794 59.9350 72.9014 172.1720 354 L 5.0327 8.4676 124.5018 53.5495 44.2918 174.5892 355 K 4.6936 8.9402 128.4117 54.6851 34.5093 174.8213 356 V 4.5365 8.5016 127.1834 61.3796 34.5082 173.8328 357 H 4.8838 8.8526 126.2082 54.5518 29.2915 172.9895 358 Y 5.3824 8.3807 130.7667 56.0587 38.4028 177.1027 359 K 3.8262 6.7811 114.9933 58.3491 32.4300 175.9911 360 Y 4.8744 6.9380 114.9329 55.2561 40.8181 173.6847 361 T 5.1676 8.4587 116.0813 62.1068 70.6732 174.5958 362 V 4.7231 8.5942 117.4602 59.7538 36.3163 174.4622 363 V 5.2744 7.9307 120.3479 60.1303 35.1223 174.4385 *365 K 4.4044 8.4395 121.7119 56.7915 33.0251 175.2283 366 T 4.7966 8.7971 116.7782 60.6995 71.3121 172.9316 367 Q 4.3738 8.5671 124.5954 54.1465 30.3737 173.8090 368 P 2.9700 0.0000 0.0000 63.7458 31.4518 176.4788 369 G 2.8726 5.3800 110.8855 44.1856 0.0000 173.1529 370 L 3.9959 6.1495 118.3911 54.3731 42.4191 176.2555 371 P 4.6363 0.0000 0.0000 62.2117 33.4229 177.0243 372 Y 4.1851 8.7472 120.6100 61.2813 38.7301 178.6341 373 S 3.9363 8.2792 115.3055 62.0623 62.7336 176.8284 374 Q 4.0013 7.9067 118.4837 58.6076 28.6432 178.3842 375 V 3.7114 7.6589 118.6174 65.9314 31.8437 177.6353 376 R 3.8779 7.9963 118.7728 59.3083 29.7718 178.5701 377 D 4.4219 7.5788 114.1306 54.9980 40.8688 177.7515 *379 V 3.9216 7.7349 119.4351 62.4276 33.4785 177.2574 380 S 3.9958 8.3059 114.5061 61.3447 62.8115 176.4073 381 K 3.9249 8.3006 119.6027 59.4060 32.0513 179.1712 382 K 3.8715 8.1393 118.1198 59.3914 32.0472 177.1651 383 L 4.3765 8.0306 115.4066 53.9512 41.9816 176.1933 384 E 3.7999 7.5222 117.4364 57.6594 27.5678 174.6005 385 L 4.7731 7.6375 116.3068 52.4323 44.6709 177.5852 386 R 3.9460 8.3803 121.1732 56.0659 30.9844 177.1862 387 L 3.8492 8.8321 125.1012 58.4512 42.0744 179.2119 388 E 4.0497 8.1190 115.5883 59.2632 29.5210 177.3006 389 H 4.7475 8.2377 114.4780 55.8439 28.6809 175.5514 390 T 4.2477 7.7026 118.1588 61.8882 67.8160 173.5233 391 K 4.5910 8.3296 125.9351 54.6990 34.3584 175.1333 392 L 5.4095 8.5526 124.9795 53.3196 44.8422 175.8864 393 S 5.5129 9.2755 116.7876 57.3494 67.9616 172.3423 394 Y 5.5100 8.7999 118.5197 55.5912 42.0483 173.9760 395 R 4.4731 8.8431 120.4608 54.2312 31.1015 174.4236 396 P 4.5808 0.0000 0.0000 61.5797 32.1984 175.3158 397 R 4.0875 8.4479 118.8580 57.4071 29.6604 175.4345 398 D 4.5063 8.8503 124.1092 55.3328 38.1335 173.5461 399 S 4.7719 7.6026 112.1534 56.7019 64.2206 173.7868 400 N 4.5310 8.4995 121.9704 54.4258 39.0773 175.3656 401 E 4.3130 7.6681 117.2808 54.9205 30.8411 175.8917 402 L 4.3416 7.8445 122.3623 54.4587 43.1551 176.2687 403 V 4.3778 8.1949 119.8093 60.2446 35.1545 173.0574 404 P 4.7266 0.0000 0.0000 62.6232 31.9314 175.7445 405 L 4.5965 8.7307 126.6483 55.0193 42.9452 175.9175 406 S 3.2427 8.2523 118.9098 56.6754 66.1656 173.9347 407 E 4.1275 8.2313 119.4730 59.8535 29.1808 178.8634 408 D 4.4681 7.9637 117.1543 56.6585 41.7176 177.3559 409 S 4.4806 7.7083 116.1176 56.6373 61.8323 174.3162 *411 K 4.3951 7.8028 125.9421 57.3184 34.4363 178.1079 412 D 4.3105 8.2494 115.9959 57.2304 41.3584 177.4375 413 A 3.3085 7.3511 121.1542 54.9584 18.0557 179.7748 414 W 4.3030 7.9583 116.6808 59.5335 28.9622 178.3371 415 G 3.9319 7.8544 104.0463 46.3729 0.0000 173.9256 416 Q 4.6092 8.0121 120.0465 55.3823 29.1667 175.5273 417 V 3.9795 7.4903 118.6787 63.0571 32.3687 175.3719 418 K 4.3651 9.0161 127.1732 55.9299 35.1864 175.6029 419 N 3.9773 9.6063 124.8577 54.9788 37.3739 173.2615 420 Y 3.2980 7.2066 109.4755 58.6970 35.9162 168.7727 421 C 5.3918 7.9374 119.4839 57.7095 35.3177 172.2294 422 L 4.8486 8.9386 128.4177 53.9622 43.4005 174.8781 423 T 4.7867 8.4314 123.1860 62.1092 69.9632 174.1193 424 L 5.1210 8.7096 125.7114 52.6725 45.9698 175.2951 425 W 5.0965 9.3306 120.4910 55.0936 32.6480 174.3832 426 C 5.1844 9.1428 124.6150 57.2113 33.2775 172.6705 427 E 4.0302 9.0295 128.5998 57.7353 29.9400 176.6210 428 N 4.4996 9.0953 122.5138 53.7463 38.2646 174.2610 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 347 G 8.35 3.84 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 0.00 0.00 0.00 348 S 8.26 4.19 0.00 4.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.89 4.38 0.00 3.17 3.26 0.00 5.78 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 *351 A 7.71 4.12 1.21 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 0.00 0.00 0.00 0.00 0.00 352 Y 8.56 5.21 0.00 3.08 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 0.00 353 T 8.89 5.04 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 354 L 8.47 5.03 0.00 1.84 1.56 0.78 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 355 K 8.94 4.69 0.00 1.75 1.49 0.00 1.48 0.00 0.00 1.49 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.97 1.06 7.81 356 V 8.50 4.54 1.98 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 0.83 0.00 0.00 0.83 0.00 0.00 357 H 8.85 4.88 0.00 2.55 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 358 Y 8.38 5.38 0.00 2.57 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 359 K 6.78 3.83 0.00 1.29 1.68 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.08 0.35 7.81 360 Y 6.94 4.87 0.00 3.19 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 0.00 361 T 8.46 5.17 4.33 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 0.00 0.00 0.00 1.15 0.00 0.00 362 V 8.59 4.72 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 363 V 7.93 5.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.91 0.00 0.00 *365 K 8.44 4.40 0.00 1.73 1.81 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.72 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.47 7.81 366 T 8.80 4.80 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 367 Q 8.57 4.37 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 368 P 0.00 2.97 0.00 1.29 0.49 0.00 3.46 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.24 0.00 369 G 5.38 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 370 L 6.15 4.00 0.00 2.11 1.86 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 371 P 0.00 4.64 0.00 2.22 2.04 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 372 Y 8.75 4.19 0.00 3.17 3.03 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 0.00 0.00 0.00 373 S 8.28 3.94 0.00 3.92 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 374 Q 7.91 4.00 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.06 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 375 V 7.66 3.71 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 0.71 0.00 0.00 1.09 0.00 0.00 376 R 8.00 3.88 0.00 1.07 1.50 0.00 3.27 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 377 D 7.58 4.42 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *379 V 7.73 3.92 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 0.86 0.00 0.00 0.88 0.00 0.00 380 S 8.31 4.00 0.00 3.80 4.01 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 0.00 381 K 8.30 3.92 0.00 1.85 1.82 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 382 K 8.14 3.87 0.00 1.68 1.95 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.58 7.81 383 L 8.03 4.38 0.00 1.40 1.28 0.33 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 384 E 7.52 3.80 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 2.27 2.29 0.00 385 L 7.64 4.77 0.00 1.49 1.49 0.45 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 386 R 8.38 3.95 0.00 1.67 1.91 0.00 3.12 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 387 L 8.83 3.85 0.00 1.67 1.68 0.85 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 388 E 8.12 4.05 0.00 1.97 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 2.32 2.41 0.00 389 H 8.24 4.75 0.00 3.23 3.30 0.00 5.64 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 390 T 7.70 4.25 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 391 K 8.33 4.59 0.00 1.73 1.78 0.00 1.87 0.00 0.00 1.85 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.47 7.81 392 L 8.55 5.41 0.00 1.74 1.65 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 393 S 9.28 5.51 0.00 3.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 394 Y 8.80 5.51 0.00 3.13 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 0.00 395 R 8.84 4.47 0.00 1.76 2.03 0.00 3.30 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 396 P 0.00 4.58 0.00 2.18 1.96 0.00 3.60 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.61 0.00 397 R 8.45 4.09 0.00 1.80 1.94 0.00 3.26 0.00 0.00 2.98 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 398 D 8.85 4.51 0.00 2.87 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 399 S 7.60 4.77 0.00 3.75 3.74 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 0.00 400 N 8.50 4.53 0.00 2.68 2.78 0.00 0.00 6.94 7.66 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 0.00 401 E 7.67 4.31 0.00 1.83 1.74 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 2.18 2.27 0.00 402 L 7.84 4.34 0.00 1.31 1.39 0.33 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 403 V 8.19 4.38 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.78 0.00 0.00 404 P 0.00 4.73 0.00 1.96 1.97 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 405 L 8.73 4.60 0.00 1.92 1.76 1.06 0.61 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 0.00 406 S 8.25 3.24 0.00 3.69 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 407 E 8.23 4.13 0.00 1.94 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 2.50 2.36 0.00 408 D 7.96 4.47 0.00 2.62 2.71 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 0.00 0.00 0.00 0.00 409 S 7.71 4.48 0.00 4.26 4.10 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 0.00 0.00 0.00 *411 K 7.80 4.40 0.00 1.91 1.99 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.49 7.81 412 D 8.25 4.31 0.00 2.70 2.88 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 0.00 0.00 0.00 413 A 7.35 3.31 0.42 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 0.00 414 W 7.96 4.30 0.00 3.51 3.13 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 0.00 0.00 0.00 415 G 7.85 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 416 Q 8.01 4.61 0.00 2.31 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.92 0.00 0.00 0.00 0.00 0.00 2.60 2.85 0.00 417 V 7.49 3.98 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.43 0.00 0.00 418 K 9.02 4.37 0.00 1.75 1.60 0.00 1.85 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.31 7.81 419 N 9.61 3.98 0.00 2.75 2.75 0.00 0.00 7.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 420 Y 7.21 3.30 0.00 3.08 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 0.00 421 C 7.94 5.39 0.00 3.03 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 422 L 8.94 4.85 0.00 1.81 1.41 0.81 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 423 T 8.43 4.79 4.11 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 0.00 0.00 0.49 0.00 0.00 424 L 8.71 5.12 0.00 1.38 1.53 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 425 W 9.33 5.10 0.00 3.33 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 0.00 426 C 9.14 5.18 0.00 2.94 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 427 E 9.03 4.03 0.00 2.19 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 2.37 2.35 0.00 428 N 9.10 4.50 0.00 3.01 3.16 0.00 0.00 6.89 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.