NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 301 F 4.4324 8.3249 122.8188 57.9430 41.2991 175.3037 302 I 3.6611 7.8999 121.7567 60.3837 37.0225 174.3519 303 D 4.5003 8.5265 124.6406 51.6030 44.2577 174.6315 304 E 3.9636 8.6728 128.7075 59.1959 29.7783 178.0364 305 D 4.3328 8.1307 118.7237 57.2707 40.7832 178.9016 306 K 4.0151 8.1032 118.5570 59.4769 32.0372 179.1920 307 M 4.0369 7.7489 119.0313 58.5088 31.9308 178.4457 308 D 4.3357 8.3008 119.2187 57.4043 40.9718 178.7801 309 Q 3.9291 8.1110 119.9818 58.9386 29.0568 177.8518 310 L 3.8809 8.0321 121.4495 58.1725 42.1159 178.5779 311 L 3.9459 8.0880 120.5762 58.2944 41.9889 178.9740 312 Q 3.9884 8.2192 117.4995 59.4166 28.2444 178.4791 313 M 4.0415 7.8152 119.8951 58.1231 32.3338 178.4677 314 L 4.1186 8.0584 119.0284 58.0031 41.6600 179.3429 315 Q 4.0494 7.9761 116.8592 59.0074 28.8246 178.7215 316 S 4.5089 7.8301 111.5184 58.0770 63.6569 174.0266 317 T 4.1231 7.2486 120.7903 62.8019 68.9372 173.8853 318 D 4.4715 8.6281 126.6778 53.1420 41.1896 174.9366 319 P 4.4382 0.0000 0.0000 65.0511 31.4282 177.1533 320 S 4.5286 8.6146 115.1064 58.8563 63.1997 175.0668 321 D 4.3397 7.6593 118.2265 53.5783 39.5352 176.0827 322 D 4.4371 7.3723 118.6426 55.5036 39.0566 173.0910 323 Q 4.6340 8.3873 117.2086 53.1976 30.7790 174.2905 324 P 4.5607 0.0000 0.0000 62.1607 32.4222 175.4116 325 D 4.6071 8.2343 118.1336 53.5111 41.6979 177.3848 326 L 4.1181 8.3088 122.3390 54.2951 43.5489 176.6092 327 P 4.2557 0.0000 0.0000 66.0225 31.3195 178.5099 328 E 3.9510 8.1617 117.3505 59.0682 29.4623 178.5454 329 L 3.9282 7.7103 119.7560 58.3269 42.3933 178.7402 330 L 3.9675 7.9611 118.8957 57.9681 41.4879 179.2311 331 H 4.1390 8.3518 118.1766 59.2461 29.8117 177.1867 332 L 3.9245 7.9904 120.8266 57.7592 41.4536 179.1087 333 E 3.8855 8.4651 119.0701 59.4145 29.7203 178.8186 334 A 4.0706 7.9447 120.6301 55.3510 18.1609 179.5829 335 M 4.1371 7.7416 116.4011 58.9120 32.3202 178.5417 336 C 4.3279 8.4545 117.2280 62.8927 28.0988 175.5662 337 H 4.2898 8.4532 120.0423 59.5204 29.0190 177.4011 338 Q 3.9983 8.1927 119.2063 58.9999 28.4928 178.5308 339 M 4.4144 8.1474 119.7863 58.0179 31.8597 178.7705 340 G 3.6314 7.8629 106.2653 47.5750 0.0000 173.8168 341 P 4.2607 0.0000 0.0000 65.1229 31.3963 178.7458 342 L 4.0413 7.4303 114.5940 57.6509 41.4815 179.5620 343 I 3.7721 7.8943 119.9060 64.4196 36.9810 178.1054 344 D 4.3510 8.2634 119.8439 57.3223 40.6164 178.4867 345 E 4.0745 8.2161 119.7700 59.1931 29.5503 179.0204 346 K 3.9407 7.9492 118.1916 59.5018 32.1771 179.3255 347 L 3.9475 8.0923 119.2433 57.6339 41.5268 178.8145 348 E 3.8846 8.4245 119.7054 59.6427 29.4839 178.7283 349 D 4.3422 8.0070 118.2951 57.5537 40.9139 178.7976 350 I 3.7278 7.9576 120.3441 64.6020 37.1157 178.2539 351 D 4.3388 8.6292 119.9025 57.2530 40.6501 178.7037 352 R 3.8730 8.1038 119.1613 59.5722 30.0289 178.7120 353 K 4.1350 8.1100 118.1374 59.6821 31.9777 178.8790 354 H 4.0758 8.5053 118.9038 59.1568 29.7244 177.4296 355 S 4.1622 8.1467 116.1461 61.5435 62.7612 176.3673 356 E 3.9293 8.1857 122.2500 59.1982 29.2820 179.4503 357 L 4.0193 8.2382 119.3333 57.6397 41.5552 179.5388 358 S 4.0746 8.4649 113.8068 61.1793 62.3216 175.7637 359 E 3.9035 8.4896 122.4486 59.0582 29.2679 178.5739 360 L 3.9334 7.9145 120.5069 58.0287 42.0741 178.4104 361 N 4.2511 8.2380 117.0367 56.6287 38.9021 176.7613 362 V 3.5718 7.9591 119.7353 66.1918 31.5561 178.1815 363 K 3.9884 8.0576 118.0202 59.3052 31.8516 179.3351 364 V 3.5195 8.1377 118.8869 66.3848 31.4072 177.7627 365 M 4.0330 8.2350 118.3362 58.7889 31.9122 178.8470 366 E 3.9690 8.3848 118.1481 59.1699 29.5629 179.3157 367 A 4.0525 8.0579 121.1324 55.1065 18.5622 179.7076 368 L 4.0389 8.0533 117.5894 57.8322 41.6388 179.8066 369 S 4.1830 8.3817 115.5187 61.4409 62.6653 176.4522 370 L 3.9430 8.1242 123.0561 58.1805 41.7572 178.0652 371 Y 4.0827 8.1766 119.4685 61.2735 38.7274 178.2314 372 T 3.8041 7.9956 115.9362 66.7528 68.4070 176.6112 373 K 3.9404 7.9700 118.8736 59.6019 32.1989 179.1510 374 L 4.0959 8.1554 119.4077 57.8952 41.2591 179.4541 375 M 3.9124 7.7959 118.2507 57.9451 31.8833 177.3045 376 N 4.6584 7.7574 114.2933 53.7358 39.1456 174.6275 377 E 4.1672 7.6796 124.1485 56.8601 29.6914 176.1361 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 301 F 8.32 4.43 0.00 3.04 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 0.00 302 I 7.90 3.66 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.90 0.94 0.00 0.00 303 D 8.53 4.50 0.00 2.50 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 304 E 8.67 3.96 0.00 2.07 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 2.39 0.00 305 D 8.13 4.33 0.00 2.88 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 K 8.10 4.02 0.00 1.90 1.79 0.00 1.50 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.60 7.81 307 M 7.75 4.04 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 308 D 8.30 4.34 0.00 2.82 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 0.00 309 Q 8.11 3.93 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 310 L 8.03 3.88 0.00 1.86 1.79 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 311 L 8.09 3.95 0.00 1.79 1.79 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 312 Q 8.22 3.99 0.00 2.37 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 313 M 7.82 4.04 0.00 2.03 2.31 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.58 0.00 314 L 8.06 4.12 0.00 1.81 1.71 0.92 0.76 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 0.00 315 Q 7.98 4.05 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 316 S 7.83 4.51 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 0.00 317 T 7.25 4.12 4.34 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 1.21 0.00 0.00 318 D 8.63 4.47 0.00 2.75 2.56 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 0.00 0.00 0.00 0.00 319 P 0.00 4.44 0.00 2.21 2.17 0.00 3.80 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 320 S 8.61 4.53 0.00 3.95 3.92 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 0.00 0.00 0.00 321 D 7.66 4.34 0.00 2.81 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 0.00 322 D 7.37 4.44 0.00 2.76 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 0.00 323 Q 8.39 4.63 0.00 2.26 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.92 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 324 P 0.00 4.56 0.00 2.18 2.08 0.00 3.76 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 1.98 1.98 0.00 325 D 8.23 4.61 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.31 4.12 0.00 1.65 1.59 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 327 P 0.00 4.26 0.00 2.15 2.12 0.00 3.60 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 2.12 2.17 0.00 328 E 8.16 3.95 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 329 L 7.71 3.93 0.00 1.80 1.86 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 330 L 7.96 3.97 0.00 1.77 1.73 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 331 H 8.35 4.14 0.00 3.34 3.50 0.00 5.79 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 0.00 332 L 7.99 3.92 0.00 1.90 1.70 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 333 E 8.47 3.89 0.00 2.15 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 2.29 2.32 0.00 334 A 7.94 4.07 1.38 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 0.00 0.00 0.00 335 M 7.74 4.14 0.00 1.88 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 336 C 8.45 4.33 0.00 2.96 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 0.00 337 H 8.45 4.29 0.00 3.39 3.48 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 338 Q 8.19 4.00 0.00 2.52 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.53 2.59 0.00 339 M 8.15 4.41 0.00 2.13 2.36 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.76 0.00 340 G 7.86 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.26 0.00 2.12 2.10 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 342 L 7.43 4.04 0.00 1.94 1.72 0.85 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 343 I 7.89 3.77 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.76 0.92 0.00 0.00 344 D 8.26 4.35 0.00 2.83 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 0.00 345 E 8.22 4.07 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 2.30 2.35 0.00 346 K 7.95 3.94 0.00 2.04 1.85 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.64 7.81 347 L 8.09 3.95 0.00 1.81 1.71 0.92 0.67 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 0.00 348 E 8.42 3.88 0.00 2.00 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 0.00 2.32 2.38 0.00 349 D 8.01 4.34 0.00 2.92 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 0.00 350 I 7.96 3.73 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.67 0.92 0.00 0.00 351 D 8.63 4.34 0.00 2.77 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 0.00 352 R 8.10 3.87 0.00 1.99 2.07 0.00 3.10 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 1.68 0.00 353 K 8.11 4.13 0.00 2.02 1.85 0.00 1.93 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.45 7.81 354 H 8.51 4.08 0.00 3.36 3.30 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 355 S 8.15 4.16 0.00 4.12 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 0.00 356 E 8.19 3.93 0.00 2.18 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 0.00 2.33 2.35 0.00 357 L 8.24 4.02 0.00 1.79 1.65 0.96 0.71 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 0.00 358 S 8.46 4.07 0.00 3.80 3.88 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 0.00 359 E 8.49 3.90 0.00 2.16 2.06 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 2.30 2.36 0.00 360 L 7.91 3.93 0.00 1.81 1.84 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 361 N 8.24 4.25 0.00 2.97 2.91 0.00 0.00 6.85 7.08 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 0.00 362 V 7.96 3.57 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 0.98 0.00 0.00 1.00 0.00 0.00 363 K 8.06 3.99 0.00 1.98 1.84 0.00 1.75 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.63 1.59 7.81 364 V 8.14 3.52 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 1.01 0.00 0.00 0.94 0.00 0.00 365 M 8.23 4.03 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.60 0.00 366 E 8.38 3.97 0.00 2.03 2.01 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 2.34 2.53 0.00 367 A 8.06 4.05 1.42 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 0.00 368 L 8.05 4.04 0.00 1.88 1.74 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 369 S 8.38 4.18 0.00 4.03 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 0.00 370 L 8.12 3.94 0.00 1.89 1.90 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 371 Y 8.18 4.08 0.00 3.19 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 8.00 3.80 4.27 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 0.00 0.00 0.00 1.23 0.00 0.00 373 K 7.97 3.94 0.00 1.89 1.86 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.58 7.81 374 L 8.16 4.10 0.00 1.69 1.62 0.92 1.23 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 0.00 375 M 7.80 3.91 0.00 1.76 2.02 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 376 N 7.76 4.66 0.00 2.67 2.77 0.00 0.00 7.26 7.24 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 0.00 377 E 7.68 4.17 0.00 2.11 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00