NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 338 M 4.3721 8.3001 120.3245 55.3084 33.1478 175.0677 339 A 4.1197 7.5802 121.8660 51.3973 19.8112 172.4829 340 V 3.8937 9.4859 120.9777 64.2822 33.6344 174.5108 341 Y 4.9296 8.5985 117.5927 55.1817 37.9851 172.5886 342 P 4.7592 0.0000 0.0000 62.0487 32.8599 176.0532 343 C 4.1971 9.2070 125.6947 59.4877 31.9242 175.0112 344 G 2.9431 7.8853 115.2430 47.6459 0.0000 174.1362 345 I 4.3079 7.5692 119.1644 63.0194 38.0078 176.5000 346 C 4.3398 7.9637 113.4499 57.9618 30.3700 175.3423 347 T 3.5542 7.9766 108.9104 61.9199 68.4536 171.9024 348 N 4.6328 7.5463 119.4006 52.8410 39.8917 174.1274 349 E 4.1618 8.8288 122.3434 57.2069 30.4129 176.5380 350 V 4.2712 8.4260 126.8627 61.6877 32.0513 175.3346 351 N 4.7357 9.3193 126.5238 52.1826 39.6407 176.5640 352 D 4.2573 8.4384 119.7944 56.8156 41.0519 177.1434 353 D 4.7480 7.9573 116.8487 52.9285 39.7375 175.7452 354 Q 4.6056 7.3560 118.1371 54.0104 31.1388 175.1073 355 D 4.2951 8.5823 120.9332 54.1834 41.5086 175.2280 356 A 5.2102 8.5542 123.7926 50.9670 22.5351 174.8351 357 I 4.6838 8.9493 119.2007 59.0826 41.8936 173.8770 358 L 4.0023 7.6371 129.9331 54.1160 43.0962 176.8605 359 C 4.6900 9.2879 127.6940 59.5336 29.6248 173.2831 360 E 4.3345 8.8076 122.8438 57.5657 29.5616 177.7654 361 A 4.0057 7.7401 122.5355 55.0178 17.9596 177.2522 362 S 4.6432 7.0124 108.0425 59.7246 69.4214 174.5323 363 C 4.2314 7.9400 115.0605 58.9480 30.4629 174.6338 364 Q 3.5494 8.2686 118.6145 56.7472 26.6901 173.0790 365 K 4.6217 7.5307 116.2894 55.7823 33.7926 176.5205 366 W 4.9834 8.8035 122.4961 56.5979 31.0065 175.3438 367 F 5.1425 9.4641 120.9705 55.7844 42.9944 174.3428 368 H 4.5548 8.9670 120.5691 55.9105 29.3582 175.9027 369 R 3.7634 8.7153 125.6423 59.8788 30.2134 178.3337 370 I 3.8302 7.8528 117.8162 64.7005 36.8416 177.9271 371 C 4.1902 8.1614 116.0203 63.1321 28.0921 175.8314 372 T 4.2679 7.7081 109.3524 62.6104 68.5965 175.8118 373 G 3.8978 7.8010 109.3933 45.6861 0.0000 173.0385 374 M 4.1976 7.6388 119.5293 54.9414 32.9452 176.9828 375 T 4.2227 8.2715 116.2791 61.2436 71.2193 175.3946 376 E 3.9974 8.6543 121.3170 60.0367 29.4153 179.8695 377 T 3.8653 7.9049 114.8903 66.6174 68.6130 176.3890 378 A 3.9868 8.2187 122.7776 55.2356 17.8180 179.0780 379 Y 4.0008 8.2646 118.1439 60.8418 38.9322 178.5232 380 G 3.5939 8.4532 106.9208 47.5390 0.0000 175.4403 381 L 3.9203 8.1859 122.8930 58.0496 41.9707 179.1149 382 L 3.9771 8.0209 117.9197 57.9642 41.5520 179.3035 383 T 3.8272 7.5742 114.7199 66.6307 68.4778 176.3021 384 A 4.3177 7.7717 120.9740 53.6257 19.3333 178.2087 385 E 4.2025 7.9630 117.7687 54.8067 28.4354 176.5754 386 A 3.9736 8.3754 126.9893 54.9379 18.6145 178.7772 387 S 4.4944 7.9628 108.0101 58.4727 63.6163 173.8109 388 A 4.6547 7.6031 123.9161 50.8537 20.1612 176.8747 389 V 4.6597 8.0159 112.9807 59.2759 35.8748 174.7076 390 W 4.7761 8.7861 131.9459 55.5959 33.4301 174.5155 391 G 3.8670 7.5206 112.4740 43.7882 0.0000 172.6098 392 C 3.4190 7.0676 117.6387 56.8245 30.8370 174.2934 393 D 4.2140 8.4540 119.9981 57.8241 39.9224 179.2522 394 T 3.8184 7.7477 115.5211 66.9927 68.3257 176.3536 395 C 4.1042 7.7190 116.6218 63.0288 28.2830 175.6588 396 M 4.0664 7.9360 119.4805 58.0571 31.5350 178.3336 397 A 4.0898 7.7533 120.4656 54.9667 18.5966 177.6201 398 D 4.5667 7.5777 120.6903 54.7636 41.0292 176.2284 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 338 M 8.30 4.37 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 339 A 7.58 4.12 1.26 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 0.00 0.00 0.00 340 V 9.49 3.89 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 0.30 0.00 0.00 0.84 0.00 0.00 341 Y 8.60 4.93 0.00 2.87 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 0.00 342 P 0.00 4.76 0.00 1.93 2.12 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 343 C 9.21 4.20 0.00 2.89 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 0.00 344 G 7.89 2.94 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 0.00 0.00 0.00 345 I 7.57 4.31 2.09 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.18 1.02 0.00 0.00 346 C 7.96 4.34 0.00 3.13 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 0.00 347 T 7.98 3.55 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 1.22 0.00 0.00 348 N 7.55 4.63 0.00 2.81 2.81 0.00 0.00 6.52 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 0.00 349 E 8.83 4.16 0.00 1.96 1.89 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 2.30 2.40 0.00 350 V 8.43 4.27 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 0.66 0.00 0.00 0.82 0.00 0.00 351 N 9.32 4.74 0.00 2.84 2.72 0.00 0.00 6.67 8.22 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 0.00 352 D 8.44 4.26 0.00 2.60 2.65 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 0.00 0.00 0.00 0.00 353 D 7.96 4.75 0.00 2.75 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 354 Q 7.36 4.61 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 355 D 8.58 4.30 0.00 2.20 1.54 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 0.00 0.00 0.00 0.00 356 A 8.55 5.21 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 0.00 357 I 8.95 4.68 1.76 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.53 -0.20 0.00 0.00 358 L 7.64 4.00 0.00 0.27 0.85 0.40 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 359 C 9.29 4.69 0.00 3.14 2.96 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 0.00 360 E 8.81 4.33 0.00 1.87 1.96 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 2.23 2.19 0.00 361 A 7.74 4.01 1.14 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 0.00 0.00 362 S 7.01 4.64 0.00 3.71 3.65 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 0.00 0.00 0.00 0.00 363 C 7.94 4.23 0.00 3.20 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 0.00 364 Q 8.27 3.55 0.00 2.32 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.97 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 365 K 7.53 4.62 0.00 1.77 1.50 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 366 W 8.80 4.98 0.00 3.28 3.09 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 0.00 0.00 0.00 0.00 367 F 9.46 5.14 0.00 2.85 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 0.00 368 H 8.97 4.55 0.00 3.31 3.22 0.00 5.84 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 369 R 8.72 3.76 0.00 1.25 1.67 0.00 3.32 0.00 0.00 2.51 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.49 0.00 370 I 7.85 3.83 1.84 0.00 0.00 0.81 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 0.30 0.90 0.00 0.00 371 C 8.16 4.19 0.00 3.28 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.71 4.27 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 1.27 0.00 0.00 373 G 7.80 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 0.00 0.00 0.00 374 M 7.64 4.20 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 375 T 8.27 4.22 4.25 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 0.00 0.00 0.00 1.22 0.00 0.00 376 E 8.65 4.00 0.00 2.05 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 0.00 2.36 2.39 0.00 377 T 7.90 3.87 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 1.22 0.00 0.00 378 A 8.22 3.99 1.34 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 0.00 0.00 379 Y 8.26 4.00 0.00 3.11 3.16 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 0.00 0.00 0.00 0.00 380 G 8.45 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 0.00 381 L 8.19 3.92 0.00 1.81 1.84 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 382 L 8.02 3.98 0.00 1.46 1.63 0.91 0.92 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 0.00 383 T 7.57 3.83 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 1.10 0.00 0.00 384 A 7.77 4.32 1.31 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 0.00 0.00 385 E 7.96 4.20 0.00 2.14 1.91 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 2.50 2.45 0.00 386 A 8.38 3.97 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 0.00 387 S 7.96 4.49 0.00 3.86 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 0.00 388 A 7.60 4.65 1.24 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 0.00 0.00 0.00 389 V 8.02 4.66 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 0.71 0.00 0.00 0.90 0.00 0.00 390 W 8.79 4.78 0.00 3.32 2.97 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 0.00 391 G 7.52 3.87 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 0.00 392 C 7.07 3.42 0.00 2.43 1.69 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 0.00 393 D 8.45 4.21 0.00 2.68 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.75 3.82 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 0.00 395 C 7.72 4.10 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 396 M 7.94 4.07 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 397 A 7.75 4.09 1.34 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 0.00 0.00 398 D 7.58 4.57 0.00 2.78 2.57 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