NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C E 4.2845 8.4401 120.2272 56.7521 30.2497 177.1629 1B A 4.3800 8.6656 127.6353 52.5218 20.5440 175.0661 1A D 4.7267 7.8906 114.4007 53.8926 42.0822 174.3431 1 C 4.0891 7.7775 113.1400 59.8498 29.8186 174.8720 2 G 3.9407 8.8055 108.4974 45.7017 0.0000 173.2257 3 L 4.5967 7.3250 118.7479 52.7720 42.8072 176.3341 4 R 4.3350 8.7951 124.1675 54.7908 31.0533 175.8551 5 P 4.1995 0.0000 0.0000 65.7655 31.3126 177.2186 6 L 4.2936 7.8009 113.5041 54.5986 42.0061 176.6146 7 F 4.6721 7.2790 114.9275 58.1360 41.8905 176.5475 8 E 4.0370 8.9791 121.7992 60.0013 30.1946 179.9863 9 K 3.9897 8.2109 116.6463 58.6630 32.1148 177.8956 10 K 4.3329 7.8623 115.2646 55.2209 32.5910 175.6828 11 S 3.7506 7.8307 112.4934 59.2414 61.2382 171.6106 12 L 4.7237 7.9491 117.3029 52.9553 43.2779 176.2491 13 E 4.8491 8.4966 121.1056 54.7527 31.1814 175.8558 14 D 4.6880 8.6999 122.3391 52.3748 40.4840 177.3324 14A K 4.0205 8.3655 117.8428 58.4001 32.2721 178.0464 14B T 4.6317 8.4404 107.7992 60.1191 70.0832 175.5411 14C E 3.8593 7.9234 122.8779 59.6129 29.3253 178.8862 14D R 3.9178 7.8893 119.0114 58.6802 29.9255 177.7427 14E E 3.8475 7.9751 119.0047 59.0470 29.8240 178.4415 14F L 3.7291 7.5218 118.6070 57.4450 41.7290 178.5792 14G L 3.5659 7.3853 120.1010 58.5546 41.7590 179.1256 14H E 3.9798 7.9479 116.2301 58.5391 29.4398 178.7467 14I S 4.3951 7.4296 113.2497 59.6478 64.7949 174.7025 14J Y 4.7124 7.3888 122.4004 56.9622 36.0447 175.3024 14K I 4.0398 7.5996 122.7046 60.9347 38.1232 175.0749 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 1C E 8.44 4.28 0.00 1.98 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 2.22 2.27 0.00 1B A 8.67 4.38 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 1A D 7.89 4.73 0.00 2.65 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 4.09 0.00 3.15 3.25 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 0.00 2 G 8.81 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 3 L 7.32 4.60 0.00 1.69 1.64 0.99 0.89 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 4 R 8.80 4.33 0.00 2.10 2.00 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 5 P 0.00 4.20 0.00 2.04 2.14 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 6 L 7.80 4.29 0.00 1.52 1.16 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.28 4.67 0.00 3.03 2.92 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 8 E 8.98 4.04 0.00 2.22 2.05 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 2.44 2.46 0.00 9 K 8.21 3.99 0.00 1.97 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.63 1.57 7.81 10 K 7.86 4.33 0.00 1.67 1.78 0.00 1.87 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.54 7.81 11 S 7.83 3.75 0.00 3.99 3.91 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 0.00 0.00 0.00 12 L 7.95 4.72 0.00 1.64 1.62 0.76 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.50 4.85 0.00 1.99 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 2.29 2.25 0.00 14 D 8.70 4.69 0.00 2.52 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 8.37 4.02 0.00 1.75 1.90 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.45 7.81 14B T 8.44 4.63 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 7.92 3.86 0.00 2.02 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 2.40 2.27 0.00 14D R 7.89 3.92 0.00 1.86 1.92 0.00 3.16 0.00 0.00 3.24 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 14E E 7.98 3.85 0.00 1.93 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 2.25 2.29 0.00 14F L 7.52 3.73 0.00 1.58 1.34 0.92 0.46 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 14G L 7.39 3.57 0.00 1.75 1.58 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 14H E 7.95 3.98 0.00 1.95 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 2.38 0.00 14I S 7.43 4.40 0.00 4.04 3.99 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 14J Y 7.39 4.71 0.00 3.07 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14K I 7.60 4.04 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 1.29 0.70 0.93 0.00 0.00