NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 321 M 4.3999 8.2893 120.3159 55.1458 33.5355 174.9275 322 T 3.9965 7.9576 110.0011 61.2832 70.7858 173.4524 323 D 4.4367 8.7835 121.4497 57.5309 41.2354 180.6142 324 G 3.5948 7.9998 105.6053 47.8726 0.0000 175.6611 325 L 4.0771 7.5722 120.5111 57.4088 41.6008 179.2160 326 N 4.3053 8.4585 116.8447 56.2929 38.3778 177.2129 327 Q 3.9408 8.2564 120.8734 59.1998 29.2454 178.0662 328 L 3.9041 7.9522 121.4024 58.0874 42.0678 178.1671 329 Y 3.9571 8.2251 119.5522 60.9642 38.7108 177.9867 330 N 4.4671 8.5860 117.3735 56.3639 38.5310 177.4659 331 L 3.9680 8.2898 120.7849 57.6791 41.6231 179.7401 332 V 3.5099 7.8637 118.0742 65.6993 31.4186 177.8104 333 A 3.9101 7.8709 120.5767 55.3918 18.2338 179.6292 334 Q 3.9400 8.2791 116.6035 59.0688 28.8066 178.4938 335 D 4.3288 8.3641 119.3118 57.6181 41.2704 177.8019 336 Y 3.9269 8.2614 119.7954 60.5941 38.7991 177.5602 337 A 4.0269 8.2516 121.7922 55.1026 18.4183 179.6940 338 L 3.8712 8.0231 117.3479 58.1890 41.7536 179.5386 339 T 3.7634 7.7137 115.6314 66.9027 68.3509 176.0547 340 D 4.1269 8.0023 119.9312 57.5454 41.1361 178.4366 341 T 3.8940 8.0023 116.3485 66.4669 68.4035 176.8141 342 I 3.7053 7.7284 121.8024 64.3673 37.1567 178.0239 343 E 3.9136 8.2135 119.7609 59.2943 29.6060 178.5552 344 A 4.0112 8.3246 121.1364 55.3235 18.4022 179.6225 345 L 4.0590 8.4702 118.0606 57.9550 41.7357 179.8504 346 S 3.5634 8.4855 114.3580 61.4225 62.7871 176.8608 347 R 3.9302 8.0304 121.5319 58.9590 29.6857 178.8314 348 M 4.0548 7.9462 118.5677 58.0816 31.8690 178.3276 349 L 4.0316 7.7650 120.4261 58.6970 42.0291 178.7436 350 H 4.1874 7.6847 114.4484 58.9692 28.7608 177.4571 351 R 4.2134 7.9816 117.3610 56.5829 30.0635 177.6387 352 G 3.9376 7.9540 107.0669 46.1068 0.0000 174.7784 353 T 4.1967 8.0495 117.6179 64.5798 68.8899 175.0662 354 I 4.6606 7.3600 113.2653 57.5036 40.7654 173.8112 355 P 4.5987 0.0000 0.0000 61.9447 33.5998 177.0727 356 L 4.0172 8.3981 119.2406 58.6550 41.9547 178.5513 357 D 4.3865 8.1836 118.1513 57.7787 40.7369 178.9377 358 T 3.9150 7.8571 115.7759 66.3647 68.5943 176.4701 359 F 4.0546 8.1664 122.4529 61.2116 39.3672 177.3099 360 V 3.3658 8.1327 118.0643 65.7529 31.2918 177.8441 361 K 3.8335 7.8207 119.1209 59.7639 32.0959 178.8503 362 Q 4.0241 8.1020 118.4029 58.6415 28.6592 178.7237 363 G 3.1492 7.9585 107.1629 47.7382 0.0000 175.8709 364 R 3.8633 8.0322 121.0587 58.7585 30.0646 178.8314 365 E 3.8726 7.8730 118.6383 59.3592 29.6979 178.8929 366 L 3.9749 7.9726 118.8154 57.7744 41.6832 179.4538 367 A 4.0220 8.1231 120.7656 54.7836 17.7483 179.6754 368 R 3.8121 8.1080 117.4096 59.8751 30.2841 178.7203 369 Q 4.0646 8.1443 117.7702 59.0786 28.5790 178.8380 370 Q 3.9791 8.2552 120.6187 59.0088 29.0436 177.7980 371 F 4.0975 8.2498 121.6962 61.5050 39.3078 177.1164 372 L 4.0221 7.8490 117.6970 57.7745 41.3386 179.6899 373 V 3.6284 7.8053 118.0383 66.1400 31.4118 178.3746 374 R 3.8414 8.2117 118.0346 58.8046 29.8616 178.6704 375 W 3.8773 8.4889 128.6557 60.7046 30.6109 177.4344 376 H 4.1608 8.5361 118.1439 59.3886 29.3372 177.2353 377 I 3.6080 7.9197 121.7239 64.4354 36.7048 178.1417 378 Q 3.8288 7.8768 119.3914 59.2090 28.8374 178.3486 379 R 3.8296 7.3689 118.2226 59.1777 30.1275 178.8030 380 I 3.9143 7.5493 119.0536 63.7649 37.0798 177.4869 381 T 4.4678 7.4508 108.7063 61.5631 69.2999 175.7437 382 S 4.1170 8.0802 118.9274 61.0623 62.9597 172.4260 383 P 4.4083 0.0000 0.0000 62.5620 31.3745 175.3269 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 321 M 8.29 4.40 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 322 T 7.96 4.00 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 1.20 0.00 0.00 323 D 8.78 4.44 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 324 G 8.00 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 0.00 325 L 7.57 4.08 0.00 1.79 1.73 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 326 N 8.46 4.31 0.00 2.95 2.87 0.00 0.00 6.65 8.60 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 0.00 327 Q 8.26 3.94 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 328 L 7.95 3.90 0.00 1.81 1.67 0.88 0.86 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 0.00 329 Y 8.23 3.96 0.00 3.20 3.12 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 0.00 0.00 0.00 330 N 8.59 4.47 0.00 3.02 2.92 0.00 0.00 7.12 6.25 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 0.00 331 L 8.29 3.97 0.00 1.77 1.67 0.64 1.06 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 0.00 332 V 7.86 3.51 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 0.89 0.00 0.00 0.90 0.00 0.00 333 A 7.87 3.91 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 334 Q 8.28 3.94 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 335 D 8.36 4.33 0.00 2.80 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 0.00 336 Y 8.26 3.93 0.00 3.10 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 0.00 337 A 8.25 4.03 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 0.00 338 L 8.02 3.87 0.00 1.86 1.70 0.93 0.54 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 0.00 339 T 7.71 3.76 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 1.04 0.00 0.00 340 D 8.00 4.13 0.00 2.29 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 0.00 341 T 8.00 3.89 4.21 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 1.20 0.00 0.00 342 I 7.73 3.71 2.00 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 1.35 0.68 0.99 0.00 0.00 343 E 8.21 3.91 0.00 2.08 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 0.00 2.30 2.38 0.00 344 A 8.32 4.01 1.39 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 0.00 0.00 0.00 345 L 8.47 4.06 0.00 2.08 2.03 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 346 S 8.49 3.56 0.00 3.68 4.05 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 0.00 0.00 0.00 347 R 8.03 3.93 0.00 1.86 2.02 0.00 3.32 0.00 0.00 3.48 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.80 0.00 348 M 7.95 4.05 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.55 0.00 349 L 7.77 4.03 0.00 1.56 1.55 0.94 0.57 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 0.00 350 H 7.68 4.19 0.00 3.26 3.29 0.00 5.72 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 351 R 7.98 4.21 0.00 1.92 1.98 0.00 3.21 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 352 G 7.95 3.94 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 0.00 353 T 8.05 4.20 4.36 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 1.22 0.00 0.00 354 I 7.36 4.66 1.92 0.00 0.00 1.00 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 0.71 0.94 0.00 0.00 355 P 0.00 4.60 0.00 2.31 2.24 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 356 L 8.40 4.02 0.00 1.80 1.74 1.01 1.18 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 0.00 357 D 8.18 4.39 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 358 T 7.86 3.91 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 359 F 8.17 4.05 0.00 3.20 3.24 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 0.00 360 V 8.13 3.37 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 1.00 0.00 0.00 1.12 0.00 0.00 361 K 7.82 3.83 0.00 1.91 1.80 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.44 7.81 362 Q 8.10 4.02 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 363 G 7.96 3.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 364 R 8.03 3.86 0.00 1.93 1.93 0.00 3.24 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 365 E 7.87 3.87 0.00 2.01 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 2.27 2.36 0.00 366 L 7.97 3.97 0.00 1.67 1.67 0.87 0.57 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 0.00 367 A 8.12 4.02 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 0.00 368 R 8.11 3.81 0.00 2.04 2.10 0.00 3.08 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 369 Q 8.14 4.06 0.00 2.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 370 Q 8.26 3.98 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 371 F 8.25 4.10 0.00 3.16 3.22 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 0.00 372 L 7.85 4.02 0.00 2.08 1.78 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 373 V 7.81 3.63 2.24 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 1.13 0.00 0.00 1.04 0.00 0.00 374 R 8.21 3.84 0.00 1.87 1.87 0.00 3.23 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 375 W 8.49 3.88 0.00 2.88 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 0.00 376 H 8.54 4.16 0.00 3.45 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 377 I 7.92 3.61 1.94 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 1.35 0.84 0.85 0.00 0.00 378 Q 7.88 3.83 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 379 R 7.37 3.83 0.00 1.89 1.87 0.00 3.33 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.06 0.00 380 I 7.55 3.91 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.57 0.88 0.00 0.00 381 T 7.45 4.47 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 1.20 0.00 0.00 382 S 8.08 4.12 0.00 3.93 4.03 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 0.00 383 P 0.00 4.41 0.00 2.17 2.04 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00