NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3120 8.1133 120.8597 56.5935 32.2403 177.5900 2 M 3.9447 7.9178 117.4832 57.2129 31.7827 176.9228 3 K 4.0950 8.7908 120.7626 59.6343 32.8473 178.4501 4 Q 4.0061 8.0306 117.8908 58.8578 28.5817 178.7017 5 I 3.6956 7.6644 120.4658 64.5054 37.1887 178.3420 6 E 3.9632 8.4442 119.6671 59.5005 29.2285 179.2207 7 D 4.3495 8.4931 119.3997 57.1659 40.8318 178.7303 8 K 3.9622 8.1003 120.2375 59.5412 32.1219 178.9418 9 I 3.7148 8.0356 120.3089 64.3113 36.9870 178.1755 10 E 3.9555 8.2536 119.4788 59.5666 29.3344 179.3001 11 E 4.0075 8.1793 118.5066 59.4219 29.4085 179.5387 12 I 3.7514 7.9758 119.9286 64.3613 37.1993 178.5089 13 L 4.0146 8.2820 120.2063 57.9129 41.4226 179.7814 14 S 4.1940 8.2009 115.1475 61.4893 62.6946 176.7044 15 K 4.0322 8.2225 122.4238 59.4282 31.8848 178.6538 16 Q 3.9983 8.4639 120.2690 59.3247 28.9668 177.6989 17 Y 4.7723 8.2107 121.9521 60.4448 38.7637 177.4061 18 H 4.0778 8.4062 119.2370 59.3250 29.9191 177.2617 19 I 3.9038 8.0381 123.2796 63.9815 37.0616 178.2897 20 E 3.9054 8.3183 119.4164 59.4602 29.2287 179.2467 21 N 4.2202 8.0372 116.5618 56.0636 38.1210 177.3107 22 E 3.8767 8.2121 120.2375 59.4940 29.4748 179.4772 23 I 3.7230 7.9985 119.8060 64.2935 37.1609 178.3177 24 A 3.9615 8.0981 121.6424 55.2370 18.0785 179.9634 25 R 3.8819 8.0017 116.6098 59.3318 30.1048 179.3674 26 I 3.6879 7.8459 119.6554 64.3533 36.8946 178.6530 27 K 3.9867 8.1315 118.5766 59.2258 32.1214 179.0529 28 K 4.0707 8.1559 120.0338 59.3471 31.9136 178.6630 29 L 3.9831 8.0003 120.1183 57.6165 42.1208 178.0382 30 I 4.2871 7.5633 110.0615 61.1113 38.0497 176.4928 31 G 3.8511 7.7554 113.1018 45.2898 0.0000 173.5029 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 1 R 8.11 4.31 0.00 1.86 1.99 0.00 3.15 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 2 M 7.92 3.94 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 3 K 8.79 4.10 0.00 1.81 1.80 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.53 7.81 4 Q 8.03 4.01 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 5 I 7.66 3.70 2.05 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 1.52 0.75 0.91 0.00 0.00 6 E 8.44 3.96 0.00 2.13 1.99 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 2.33 2.54 0.00 7 D 8.49 4.35 0.00 2.81 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 8 K 8.10 3.96 0.00 1.98 1.97 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 9 I 8.04 3.71 2.04 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 1.52 0.70 0.91 0.00 0.00 10 E 8.25 3.96 0.00 2.24 1.99 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 2.32 2.55 0.00 11 E 8.18 4.01 0.00 2.20 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 2.33 2.58 0.00 12 I 7.98 3.75 2.03 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 0.83 0.92 0.00 0.00 13 L 8.28 4.01 0.00 1.81 1.71 0.91 0.90 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 14 S 8.20 4.19 0.00 4.03 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 15 K 8.22 4.03 0.00 1.91 1.96 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.52 7.81 16 Q 8.46 4.00 0.00 2.35 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 17 Y 8.21 4.77 0.00 3.16 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 18 H 8.41 4.08 0.00 3.36 3.53 0.00 5.84 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 19 I 8.04 3.90 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.09 0.90 0.00 0.00 20 E 8.32 3.91 0.00 2.01 1.93 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 2.32 2.60 0.00 21 N 8.04 4.22 0.00 2.63 2.68 0.00 0.00 7.00 7.13 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 22 E 8.21 3.88 0.00 2.10 1.93 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 2.20 2.27 0.00 23 I 8.00 3.72 1.98 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 1.43 0.82 0.88 0.00 0.00 24 A 8.10 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.00 3.88 0.00 2.00 1.96 0.00 3.09 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 26 I 7.85 3.69 1.99 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 1.50 0.71 0.90 0.00 0.00 27 K 8.13 3.99 0.00 1.81 1.86 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.67 7.81 28 K 8.16 4.07 0.00 1.90 1.96 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 29 L 8.00 3.98 0.00 1.76 1.83 0.91 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.56 4.29 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.74 0.94 0.00 0.00 31 G 7.76 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00