NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 301 M 4.4191 8.1627 118.3243 55.2542 33.6300 173.3621 302 Q 4.7135 8.2478 121.5444 52.8935 30.9883 172.8633 303 I 4.3971 9.2205 120.6206 58.9579 42.1204 173.4866 304 F 5.5810 8.9798 120.1353 55.7988 42.7028 175.1421 305 V 4.7746 8.6106 120.1274 61.2816 35.0458 174.0206 306 K 4.7732 9.1790 130.8838 55.3335 33.4266 176.7490 307 T 4.5255 8.9235 119.5847 61.0520 69.7683 175.1080 308 L 4.0612 8.3647 120.5475 57.8251 41.6208 178.2903 309 T 4.1578 7.9011 106.4581 61.5056 69.0472 175.4409 310 G 3.8795 7.9616 109.8843 45.5971 0.0000 173.1759 311 K 4.5093 7.4292 120.3047 55.1371 34.2800 175.3217 312 T 5.0205 8.3909 123.3498 62.5453 69.6601 174.0940 313 I 4.8108 8.8651 119.8659 59.2860 41.1968 174.4893 314 T 5.1790 8.4516 112.6093 60.4415 71.1242 173.8474 315 L 4.7405 8.5367 121.9913 53.1019 46.2855 174.9502 316 E 4.7807 8.7859 124.3356 55.0853 30.5291 175.0801 317 V 4.7004 9.0850 119.8954 59.7164 36.4920 174.2307 318 E 4.6590 10.7800 121.3773 53.8095 32.1175 175.0333 319 P 4.1756 0.0000 0.0000 65.6190 31.5681 178.1230 320 S 4.3985 7.8994 110.2596 59.3409 63.8396 174.2836 321 D 4.5548 8.5614 123.2421 54.6908 41.2980 176.0567 322 T 4.8418 8.6774 113.6706 60.6415 71.8513 176.2654 323 I 3.7357 8.0643 121.6273 64.4631 37.0110 178.6490 324 E 3.9873 8.1750 119.0408 59.4348 29.3394 178.9848 325 N 4.2907 7.9344 115.9421 56.3188 38.5697 177.5664 326 V 3.5680 7.8229 119.5111 66.0673 31.5288 178.1747 327 K 4.1582 8.7283 119.6599 58.8208 31.8084 179.2200 328 A 3.9799 7.9125 121.0932 55.0302 17.7684 179.8230 329 K 3.9270 8.0754 117.0443 59.6262 32.0304 179.6894 330 I 3.7364 7.9344 120.3228 64.4039 36.9574 178.1914 331 Q 4.2503 8.2889 122.0078 58.6922 28.5630 178.1936 332 D 4.3564 7.9847 119.4641 56.5832 41.0275 177.9636 333 K 4.4237 7.5819 115.0572 57.2032 33.5378 177.1181 334 E 4.6247 8.4842 118.4709 55.0655 31.3788 176.8360 335 G 3.8743 8.1306 106.2686 45.8679 0.0000 172.8960 336 I 4.3069 7.3302 120.7044 58.4961 38.5597 173.6203 337 P 4.4000 0.0000 0.0000 61.9540 32.0568 175.3998 338 P 4.2006 0.0000 0.0000 65.8922 31.3330 177.6740 339 D 4.5609 8.0819 114.0223 54.4987 39.2955 176.0570 340 Q 4.4921 8.0713 119.9117 55.9290 30.2806 174.7865 341 Q 4.5281 7.9199 117.5135 55.6470 30.6567 174.8719 342 R 4.7871 8.7246 122.1870 54.3178 33.6697 174.3456 343 L 5.1661 8.5535 123.3623 52.9564 44.8272 175.1910 344 I 4.9930 8.7707 124.8147 59.5041 40.0353 174.5309 345 F 5.1638 9.2022 128.6625 57.0672 43.0366 174.3065 346 A 3.4787 9.0184 127.8483 53.0890 15.9344 177.8575 347 G 3.9198 8.2620 106.0479 46.7367 0.0000 174.1969 348 K 4.5519 8.1274 119.9668 54.3772 34.2683 174.8648 349 Q 4.7390 8.4747 124.2353 54.8852 29.7470 175.3099 350 L 3.7373 8.6467 128.0354 55.0591 42.2713 176.5909 351 E 4.5792 9.7044 123.8334 54.9791 31.2003 176.0275 352 D 4.4752 8.6765 124.0799 55.8099 41.7157 174.8001 353 G 4.2319 9.0490 111.1702 46.2654 0.0000 174.5847 354 R 4.3375 7.8009 118.4252 55.6435 30.6765 175.2810 355 T 5.1650 8.6844 109.3781 59.4549 71.5319 175.4014 356 L 4.1519 8.5933 122.0383 57.9784 41.4302 180.1558 357 S 4.1378 8.2153 114.3252 61.5096 62.7212 176.0510 358 D 4.3914 7.5849 121.6175 56.9738 40.6105 177.6126 359 Y 4.4983 7.3658 112.6378 56.6099 38.4139 174.8559 360 N 4.1762 8.4796 117.6972 54.4593 38.0220 174.2920 361 I 3.7395 8.1051 118.4427 60.7075 37.1359 176.0913 362 Q 4.5197 8.1768 125.1148 53.2371 30.8959 175.3347 363 K 4.0583 8.1450 117.9416 58.7750 32.6516 177.0853 364 E 3.8127 8.8746 120.2429 56.5252 28.0667 175.0508 365 S 4.5571 7.7338 115.6930 58.8813 64.2634 173.2619 366 T 5.1614 8.7476 119.2217 62.0115 70.6017 173.5945 367 L 4.7168 9.0951 127.0327 53.7708 44.3230 175.4399 368 H 5.0909 8.8897 119.7176 54.0426 30.8386 173.3657 369 L 4.7939 8.4108 126.9484 54.4693 42.7194 176.2619 370 V 4.5737 8.9836 118.8902 59.6346 36.1255 174.9848 371 L 4.9317 8.3370 122.8256 54.4533 41.6537 176.6160 372 R 4.6504 8.3427 122.5117 55.9251 34.0173 175.1817 373 L 4.6009 8.1692 122.7848 52.6687 41.4591 175.8543 374 R 4.1655 8.0835 121.1441 56.0571 31.0950 177.2655 375 G 3.7341 8.3196 109.1520 46.1469 0.0000 172.7217 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 M 8.16 4.42 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 302 Q 8.25 4.71 0.00 2.12 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.66 0.00 0.00 0.00 0.00 0.00 1.88 2.25 0.00 303 I 9.22 4.40 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.48 0.79 0.00 0.00 304 F 8.98 5.58 0.00 3.00 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 0.00 305 V 8.61 4.77 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 1.03 0.00 0.00 0.92 0.00 0.00 306 K 9.18 4.77 0.00 1.83 1.71 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.39 7.81 307 T 8.92 4.53 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 1.27 0.00 0.00 308 L 8.36 4.06 0.00 1.66 1.78 0.92 0.87 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 0.00 309 T 7.90 4.16 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 0.00 310 G 7.96 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 0.00 0.00 0.00 311 K 7.43 4.51 0.00 1.96 1.67 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.40 7.81 312 T 8.39 5.02 4.16 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 1.09 0.00 0.00 313 I 8.87 4.81 1.90 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 1.49 0.91 0.93 0.00 0.00 314 T 8.45 5.18 4.22 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 1.41 0.00 0.00 315 L 8.54 4.74 0.00 1.47 1.46 0.88 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 316 E 8.79 4.78 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 317 V 9.08 4.70 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 0.64 0.00 0.00 0.91 0.00 0.00 318 E 10.78 4.66 0.00 2.17 1.72 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 2.16 2.27 0.00 319 P 0.00 4.18 0.00 2.20 2.09 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 320 S 7.90 4.40 0.00 3.97 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 0.00 321 D 8.56 4.55 0.00 2.79 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 0.00 322 T 8.68 4.84 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 0.00 323 I 8.06 3.74 1.97 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 1.84 1.08 0.93 0.00 0.00 324 E 8.18 3.99 0.00 2.01 2.00 0.00 0.00 0.00 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 2.42 0.00 325 N 7.93 4.29 0.00 2.93 2.85 0.00 0.00 6.66 7.83 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 0.00 326 V 7.82 3.57 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.97 0.00 0.00 327 K 8.73 4.16 0.00 1.96 1.84 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.59 1.44 7.81 328 A 7.91 3.98 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 0.00 329 K 8.08 3.93 0.00 2.00 1.85 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.66 7.81 330 I 7.93 3.74 2.15 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 1.40 0.81 0.93 0.00 0.00 331 Q 8.29 4.25 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 332 D 7.98 4.36 0.00 2.93 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 0.00 333 K 7.58 4.42 0.00 1.93 1.91 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.45 7.81 334 E 8.48 4.62 0.00 2.12 2.00 0.00 0.00 0.00 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 2.42 0.00 335 G 8.13 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 0.00 336 I 7.33 4.31 1.87 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 1.42 1.19 0.91 0.00 0.00 337 P 0.00 4.40 0.00 2.29 1.97 0.00 3.62 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 338 P 0.00 4.20 0.00 2.17 2.12 0.00 3.59 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 339 D 8.08 4.56 0.00 2.78 2.79 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 0.00 340 Q 8.07 4.49 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 341 Q 7.92 4.53 0.00 2.18 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 342 R 8.72 4.79 0.00 1.91 1.79 0.00 3.36 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 343 L 8.55 5.17 0.00 1.52 1.51 0.87 0.78 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 0.00 344 I 8.77 4.99 1.93 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 1.14 1.21 0.97 0.00 0.00 345 F 9.20 5.16 0.00 2.95 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 346 A 9.02 3.48 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.26 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 0.00 0.00 0.00 348 K 8.13 4.55 0.00 1.90 1.81 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.62 7.81 349 Q 8.47 4.74 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 350 L 8.65 3.74 0.00 1.38 1.25 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 351 E 9.70 4.58 0.00 2.06 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 2.35 2.40 0.00 352 D 8.68 4.48 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.05 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 0.00 0.00 0.00 0.00 354 R 7.80 4.34 0.00 2.22 1.92 0.00 3.15 0.00 0.00 2.88 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 355 T 8.68 5.16 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 356 L 8.59 4.15 0.00 1.87 1.73 0.92 0.72 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 0.00 357 S 8.22 4.14 0.00 4.06 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 0.00 358 D 7.58 4.39 0.00 2.62 2.39 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 0.00 359 Y 7.37 4.50 0.00 3.00 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 0.00 360 N 8.48 4.18 0.00 2.85 2.99 0.00 0.00 7.15 7.96 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 0.00 361 I 8.11 3.74 1.86 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.47 0.58 0.00 0.00 362 Q 8.18 4.52 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 363 K 8.14 4.06 0.00 1.77 1.77 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.46 7.81 364 E 8.87 3.81 0.00 2.20 2.41 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 2.35 2.27 0.00 365 S 7.73 4.56 0.00 3.64 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 366 T 8.75 5.16 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 1.17 0.00 0.00 367 L 9.10 4.72 0.00 1.51 1.55 0.80 0.52 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 0.00 368 H 8.89 5.09 0.00 3.22 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 369 L 8.41 4.79 0.00 1.67 1.78 0.97 0.96 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 0.00 370 V 8.98 4.57 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 0.72 0.00 0.00 1.00 0.00 0.00 371 L 8.34 4.93 0.00 1.60 1.47 0.92 0.83 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 0.00 372 R 8.34 4.65 0.00 1.74 1.77 0.00 3.16 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 373 L 8.17 4.60 0.00 1.60 1.60 0.92 0.95 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 0.00 374 R 8.08 4.17 0.00 1.80 1.86 0.00 3.22 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 375 G 8.32 3.73 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 0.00 0.00 0.00