NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1R S 4.4439 8.3193 115.2965 57.8588 62.3926 172.5191 1Q E 4.0823 8.5424 125.8593 55.0335 30.3242 174.9630 1P Y 4.5851 8.5490 123.3546 56.1380 42.8301 174.4255 1O Q 4.3604 7.6497 128.3086 53.9216 30.3415 175.2006 1N T 4.3375 8.3296 115.7915 61.8788 69.5253 173.5646 1M F 4.3596 9.7721 124.7752 58.5377 41.3294 175.6009 1L F 4.3835 8.3369 118.1659 55.8612 40.5649 174.2468 1K N 4.9055 8.4276 119.7590 51.2643 39.9100 173.2377 1J P 5.1996 0.0000 0.0000 64.9474 31.7434 178.4371 1I R 3.9300 8.6385 118.2832 58.6743 30.0252 177.0378 1H T 4.5151 7.8908 105.3991 61.9144 70.7317 174.8842 1G F 4.2750 8.8223 124.0256 58.4889 40.2197 175.8233 1F G 3.7241 8.4896 107.8217 44.3145 0.0000 172.3004 1E S 4.9611 7.9025 112.9164 57.0840 65.2913 173.7063 1D G 4.1134 8.8623 107.9559 45.9194 0.0000 175.9395 1C E 4.1201 8.8569 120.4679 59.2775 29.9527 178.3880 1B A 4.1498 8.3050 120.0633 54.8496 18.4131 177.3904 1A D 4.8149 7.4540 111.8769 53.8518 41.7184 176.0518 1 C 4.0800 7.7045 113.1048 58.9776 29.8735 174.6074 2 G 3.7931 8.6881 108.2410 45.8802 0.0000 173.2104 3 L 4.5984 7.2673 118.8056 52.6301 43.0870 176.3990 4 R 4.3080 9.0092 124.2912 54.8664 30.8558 176.0741 5 P 4.2309 0.0000 0.0000 65.4917 31.4119 177.1287 6 L 4.2883 7.7942 114.3219 54.4880 42.2419 176.4415 7 F 4.6275 7.3967 114.7933 57.8007 41.6769 176.4485 8 E 4.0259 9.2153 122.7599 60.1709 30.1422 179.8020 9 K 4.1924 8.1409 115.6842 58.1427 32.1668 177.8076 10 K 4.4231 7.7410 116.1891 55.2817 32.7847 175.7884 11 S 3.8142 7.7865 113.6056 59.8865 60.7954 172.0655 12 L 4.8609 8.1073 118.4978 52.9839 44.3313 176.3300 13 E 4.8887 8.6211 121.5084 54.7047 30.2729 175.7251 14 D 4.8170 8.8761 122.3741 52.0563 40.7262 177.6135 14A K 4.1589 8.5692 118.5920 58.9785 32.2686 178.1411 14B T 4.5635 7.5147 104.1167 60.5640 69.6543 175.4957 14C E 3.9495 8.5363 122.6464 59.4979 29.3011 178.9451 14D R 3.8546 7.9390 119.6195 59.2580 29.8824 177.7900 14E E 3.8588 7.8403 118.3621 59.0399 29.9826 178.6472 14F L 3.8894 7.5216 118.5034 57.7591 41.9719 179.2301 14G L 3.6543 7.6249 118.8439 57.7768 41.5228 179.5270 14H E 4.0399 8.4425 118.9693 58.9502 29.1367 179.1908 14I S 4.2305 7.3413 112.8295 60.7477 63.1492 175.3457 14J Y 4.6455 7.2001 118.7801 58.5202 38.0332 175.5669 14K I 4.0380 7.1286 122.1447 61.0127 37.8284 175.5086 14L D 4.2176 8.4796 123.7062 54.7592 40.9562 174.5448 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 1R S 8.32 4.44 0.00 3.88 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 1Q E 8.54 4.08 0.00 2.22 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 2.31 2.39 0.00 1P Y 8.55 4.59 0.00 2.92 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 1O Q 7.65 4.36 0.00 1.88 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 1N T 8.33 4.34 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 1M F 9.77 4.36 0.00 2.61 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 1L F 8.34 4.38 0.00 2.45 2.60 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 0.00 0.00 0.00 0.00 1K N 8.43 4.91 0.00 2.69 2.73 0.00 0.00 6.85 7.71 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 1J P 0.00 5.20 0.00 2.28 2.28 0.00 4.01 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 1I R 8.64 3.93 0.00 1.79 2.11 0.00 3.23 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 1H T 7.89 4.52 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1G F 8.82 4.27 0.00 3.00 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 1F G 8.49 3.72 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 0.00 0.00 0.00 1E S 7.90 4.96 0.00 4.01 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 1D G 8.86 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 1C E 8.86 4.12 0.00 2.46 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 0.00 2.76 2.63 0.00 1B A 8.30 4.15 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 1A D 7.45 4.81 0.00 2.71 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 1 C 7.70 4.08 0.00 3.07 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 2 G 8.69 3.79 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 0.00 0.00 0.00 3 L 7.27 4.60 0.00 1.72 1.62 0.99 0.88 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 4 R 9.01 4.31 0.00 2.23 2.06 0.00 3.19 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 5 P 0.00 4.23 0.00 2.04 2.12 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 6 L 7.79 4.29 0.00 1.40 1.18 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.40 4.63 0.00 3.06 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 8 E 9.22 4.03 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 2.45 2.48 0.00 9 K 8.14 4.19 0.00 2.02 1.87 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.19 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.52 7.81 10 K 7.74 4.42 0.00 1.62 1.73 0.00 1.81 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.57 7.81 11 S 7.79 3.81 0.00 4.05 3.95 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 0.00 0.00 0.00 12 L 8.11 4.86 0.00 1.52 1.57 0.77 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.62 4.89 0.00 2.00 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 2.44 2.32 0.00 14 D 8.88 4.82 0.00 2.50 1.63 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 14A K 8.57 4.16 0.00 1.75 1.92 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.47 7.81 14B T 7.51 4.56 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 1.18 0.00 0.00 14C E 8.54 3.95 0.00 2.16 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 2.50 2.28 0.00 14D R 7.94 3.85 0.00 1.92 1.94 0.00 3.21 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 14E E 7.84 3.86 0.00 1.98 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 2.25 2.30 0.00 14F L 7.52 3.89 0.00 1.70 1.47 0.86 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14G L 7.62 3.65 0.00 1.76 1.71 1.08 1.02 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 14H E 8.44 4.04 0.00 2.05 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 2.30 2.49 0.00 14I S 7.34 4.23 0.00 3.99 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 14J Y 7.20 4.65 0.00 3.14 2.90 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 14K I 7.13 4.04 1.97 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 1.22 0.58 0.93 0.00 0.00 14L D 8.48 4.22 0.00 2.62 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00