NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 268 D 4.4750 8.2233 120.1719 54.3164 41.3167 175.3336 269 K 2.5189 7.8950 117.7262 55.8455 31.9582 176.0057 270 H 4.7069 7.9280 115.7906 55.2134 31.7560 174.4861 271 S 4.2831 8.0775 114.6415 58.6805 63.8959 174.2525 272 D 4.4234 8.5077 123.1602 57.0447 41.2316 177.9175 273 E 3.9425 8.1455 119.4186 59.3129 29.6064 177.8182 274 Y 4.1272 8.1122 119.0942 60.8874 38.7789 178.2584 275 K 3.7738 7.8019 118.7733 59.3358 32.1201 179.4006 276 I 3.6976 7.5901 113.5683 63.7675 37.5522 178.3673 277 R 3.8226 7.9481 120.5579 59.2158 29.8221 178.7673 278 R 3.7101 7.8803 118.2009 59.0409 30.0142 178.5689 279 E 3.8628 8.2830 119.3787 59.3496 29.6269 179.1101 280 R 3.8914 8.0323 118.0528 59.3034 30.1101 178.6137 281 N 4.3106 8.1072 116.8484 56.6956 38.9633 176.6868 282 N 4.3847 8.4873 118.3466 56.2513 38.6110 177.4891 283 I 3.6714 7.8511 121.0562 64.3448 37.1535 178.3468 284 A 4.0022 8.0275 121.6392 54.9351 18.0818 179.9032 285 V 3.4936 8.2037 117.2262 66.3359 31.5935 178.5014 286 R 3.9271 7.8877 117.7371 59.0761 29.8770 179.0149 287 K 3.9129 8.0008 119.3752 59.5173 32.2389 178.8929 288 S 4.0961 8.2985 113.6065 61.4195 62.2373 176.3581 289 R 3.9352 8.3857 121.2245 59.2025 29.7500 178.6424 290 D 4.3353 8.3711 119.0486 57.3129 40.8077 178.7398 291 K 3.8492 8.1140 119.6723 59.5566 32.1979 178.6321 292 A 3.9648 8.0597 120.8727 55.2125 18.4665 179.8458 293 K 3.9834 8.3937 117.2784 59.5363 31.9510 179.3669 294 M 4.0289 8.1740 118.9622 58.4358 32.1477 178.1296 295 R 3.8599 8.2064 119.1409 59.3997 30.1386 178.0534 296 N 4.2620 8.2327 116.8472 56.5932 39.0644 176.6693 297 L 4.3170 7.6044 122.7208 57.6556 42.1000 178.8198 298 E 3.9068 8.4982 119.0032 59.6657 29.3787 179.4465 299 T 3.8805 8.0781 115.8685 66.7496 68.3534 176.8079 300 Q 4.0495 8.3031 120.0951 59.1983 28.6535 178.5605 301 H 4.3004 8.0951 117.2896 58.6751 28.7568 177.6863 302 K 3.9367 8.2285 121.6256 59.3927 31.8861 179.0004 303 V 3.5810 7.8167 118.5675 65.9352 31.4527 177.9522 304 L 3.9641 7.6991 118.6028 57.7472 41.5396 179.1401 305 E 3.8885 8.3005 119.1026 59.4739 29.5749 178.9645 306 L 4.0596 8.4963 119.1931 57.9547 41.5937 179.7499 307 T 3.8738 8.3086 116.0927 66.4640 68.4377 176.6869 308 A 4.1630 8.0210 122.8309 55.1193 18.2896 179.3520 309 E 3.8896 8.1784 117.8395 59.3052 29.6264 178.4863 310 N 4.2787 8.3804 117.4533 56.7991 38.9943 176.7472 311 E 3.9574 8.3481 120.0267 59.2021 29.5216 179.3445 312 R 3.8716 7.8638 118.7573 59.4383 30.1483 178.6359 313 L 4.0197 8.1897 119.0486 57.8124 41.6073 179.4077 314 Q 4.0109 8.3850 118.3268 59.0241 28.6580 179.1951 315 K 3.9879 8.0657 119.4175 59.2477 31.9899 179.3747 316 K 3.9301 8.1466 119.9355 59.4457 32.0620 179.0414 317 V 3.5557 8.1643 118.9854 65.8929 31.4183 177.5926 318 E 3.8895 8.2770 119.0146 59.2347 29.5032 178.3857 319 Q 3.9500 8.1461 119.5189 59.4401 29.0671 178.4477 320 L 4.0139 8.1448 119.9901 57.8544 41.5227 179.7424 321 S 4.1278 8.4229 115.4689 61.7202 62.7766 177.0202 322 R 3.9174 8.1950 120.8182 59.0346 29.7867 178.6632 323 E 3.9263 8.3391 119.2434 59.2402 29.6260 178.7283 324 L 3.9734 8.2436 120.6629 58.1855 42.2030 178.7791 325 S 4.1372 8.3772 113.4092 61.7046 62.2912 176.3367 326 T 3.8942 8.0968 118.4530 66.4849 68.3124 176.4870 327 L 4.0119 8.0188 122.2662 58.3167 42.1561 179.2080 328 R 4.0928 8.5356 118.5051 59.2690 29.9611 178.5534 329 N 4.3417 8.3514 116.9005 56.5090 38.7148 176.7920 330 L 3.9041 7.6781 119.3705 58.0072 42.1924 179.2314 331 F 4.1502 8.1141 117.2166 60.4962 38.6730 177.7254 332 K 4.1541 8.2532 117.8257 58.8986 32.0248 177.8302 333 Q 4.3987 7.5977 116.3051 55.4816 29.0165 175.5482 334 L 4.0672 7.4865 123.2467 54.6277 42.5524 176.1302 *335 P 4.2215 0.0000 0.0000 62.6555 31.4002 173.1911 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 268 D 8.22 4.47 0.00 2.66 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 269 K 7.89 2.52 0.00 1.60 1.42 0.00 1.20 0.00 0.00 1.50 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.23 0.87 7.81 270 H 7.93 4.71 0.00 2.97 3.31 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 S 8.08 4.28 0.00 4.04 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 0.00 272 D 8.51 4.42 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 0.00 273 E 8.15 3.94 0.00 2.07 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 0.00 2.40 2.34 0.00 274 Y 8.11 4.13 0.00 3.16 3.14 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 0.00 275 K 7.80 3.77 0.00 2.13 1.83 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.88 7.81 276 I 7.59 3.70 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.76 0.98 0.00 0.00 277 R 7.95 3.82 0.00 2.20 1.99 0.00 3.10 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 278 R 7.88 3.71 0.00 1.65 1.74 0.00 3.08 0.00 0.00 2.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.05 0.00 279 E 8.28 3.86 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 280 R 8.03 3.89 0.00 2.02 1.93 0.00 3.15 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 281 N 8.11 4.31 0.00 2.73 2.88 0.00 0.00 7.25 6.79 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 0.00 282 N 8.49 4.38 0.00 2.86 2.83 0.00 0.00 7.02 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 I 7.85 3.67 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.11 0.90 0.00 0.00 284 A 8.03 4.00 1.37 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 0.00 0.00 0.00 285 V 8.20 3.49 2.22 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 1.08 0.00 0.00 1.00 0.00 0.00 286 R 7.89 3.93 0.00 1.91 1.96 0.00 3.17 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 287 K 8.00 3.91 0.00 1.92 1.97 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 288 S 8.30 4.10 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 289 R 8.39 3.94 0.00 1.95 1.95 0.00 3.35 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 290 D 8.37 4.34 0.00 2.88 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 0.00 291 K 8.11 3.85 0.00 1.88 1.98 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 292 A 8.06 3.96 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 0.00 293 K 8.39 3.98 0.00 1.91 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.63 7.81 294 M 8.17 4.03 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.57 0.00 295 R 8.21 3.86 0.00 2.01 2.10 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 296 N 8.23 4.26 0.00 2.88 2.96 0.00 0.00 6.84 5.97 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 0.00 297 L 7.60 4.32 0.00 1.78 1.77 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 298 E 8.50 3.91 0.00 2.15 1.97 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 2.31 2.62 0.00 299 T 8.08 3.88 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 300 Q 8.30 4.05 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 301 H 8.10 4.30 0.00 3.42 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 K 8.23 3.94 0.00 1.99 1.98 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 303 V 7.82 3.58 2.26 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 1.07 0.00 0.00 0.98 0.00 0.00 304 L 7.70 3.96 0.00 1.87 1.70 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 305 E 8.30 3.89 0.00 2.04 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 2.31 2.35 0.00 306 L 8.50 4.06 0.00 1.86 1.70 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 307 T 8.31 3.87 4.41 0.00 0.00 0.00 0.00 0.00 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 0.00 308 A 8.02 4.16 1.37 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 0.00 0.00 0.00 309 E 8.18 3.89 0.00 2.13 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 0.00 2.30 2.36 0.00 310 N 8.38 4.28 0.00 2.88 2.97 0.00 0.00 7.22 8.51 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 0.00 311 E 8.35 3.96 0.00 2.24 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 0.00 2.33 2.48 0.00 312 R 7.86 3.87 0.00 1.91 2.10 0.00 3.09 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 1.63 1.67 0.00 313 L 8.19 4.02 0.00 1.86 1.70 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 314 Q 8.38 4.01 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 315 K 8.07 3.99 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.59 7.81 316 K 8.15 3.93 0.00 1.99 1.94 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 317 V 8.16 3.56 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 1.03 0.00 0.00 0.99 0.00 0.00 318 E 8.28 3.89 0.00 2.13 2.07 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 2.31 2.36 0.00 319 Q 8.15 3.95 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 320 L 8.14 4.01 0.00 1.78 1.71 0.92 1.12 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 0.00 321 S 8.42 4.13 0.00 4.02 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 0.00 322 R 8.20 3.92 0.00 2.01 1.98 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 323 E 8.34 3.93 0.00 2.16 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 2.33 0.00 324 L 8.24 3.97 0.00 1.86 1.87 0.93 1.00 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 0.00 325 S 8.38 4.14 0.00 4.01 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 0.00 326 T 8.10 3.89 4.40 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 1.22 0.00 0.00 327 L 8.02 4.01 0.00 1.93 1.89 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 328 R 8.54 4.09 0.00 2.10 2.01 0.00 3.20 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 329 N 8.35 4.34 0.00 2.95 3.01 0.00 0.00 7.19 6.00 0.00 0.00 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 L 7.68 3.90 0.00 1.76 1.53 0.85 0.86 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 0.00 331 F 8.11 4.15 0.00 3.34 3.10 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 0.00 332 K 8.25 4.15 0.00 1.88 2.08 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 333 Q 7.60 4.40 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.66 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 334 L 7.49 4.07 0.00 1.70 1.66 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *335 P 0.00 4.22 0.00 1.83 1.86 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.08 0.00 * Residues marked with a * may have inaccurate shift predictions.