NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3100 8.1133 120.8601 56.7197 32.2032 177.6421 2 M 3.8714 7.9554 117.2453 57.4890 31.6710 177.1418 3 K 3.9400 8.1737 119.3875 59.2888 32.8117 178.1725 4 Q 3.9993 7.9226 119.6739 58.7472 28.7896 177.9421 5 I 3.6752 7.9184 121.3784 64.4234 36.8400 178.0117 6 E 4.0273 8.4745 119.7148 58.5540 29.3943 178.5866 7 D 4.3541 7.6896 119.1045 57.4798 41.0407 178.6047 8 K 3.9927 7.8510 118.5232 59.5524 31.9065 179.3946 9 L 4.3055 7.7572 118.8289 57.4514 41.2389 179.2165 10 E 4.0977 7.6123 117.5983 58.7491 29.7075 178.4279 11 E 4.0706 8.1346 119.6221 59.5524 29.6697 178.9471 12 I 3.7436 8.3480 120.0479 64.2780 36.9423 178.0121 13 L 4.0186 7.5747 119.6123 57.1765 42.0843 178.3678 14 S 4.7004 7.9760 114.9656 61.0357 63.3730 176.4200 15 K 4.0234 8.0202 120.6842 59.5343 31.5409 179.1846 16 L 4.0660 7.8060 119.1139 57.6553 41.0783 178.9728 17 Y 4.5962 8.2758 117.2169 60.8578 37.8989 177.3837 18 H 4.6465 8.1857 119.0908 59.1197 30.1367 177.1270 19 I 3.7643 8.0897 121.4912 63.7829 36.6395 177.7003 20 E 4.2435 7.5433 118.5300 58.0887 29.6844 177.9302 21 N 4.4847 7.5498 118.1442 56.7206 39.0670 176.7013 22 E 4.0447 8.0122 119.6167 58.8036 29.3853 178.2563 23 L 4.2886 7.9815 116.9547 55.5138 41.5749 178.2583 24 A 4.3249 7.4769 121.5461 54.0474 19.3338 179.5650 25 R 3.9528 7.8509 116.8551 60.0335 30.5013 178.5957 26 I 3.6116 7.6699 119.7324 64.4774 36.8906 177.9507 27 K 3.9844 7.3454 119.1157 59.3388 32.2541 178.7998 28 K 4.0947 8.8628 119.8821 59.4630 31.9198 179.2139 29 L 4.3165 7.9518 117.7451 56.8988 41.5712 177.9796 30 L 4.5318 7.5161 115.9136 53.9125 42.4669 176.6937 31 G 4.0449 8.4653 114.4152 45.8146 0.0000 173.6818 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 1.98 0.00 3.15 0.00 0.00 3.34 7.29 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 7.96 3.87 0.00 2.15 2.09 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 2.69 2.60 0.00 3 K 8.17 3.94 0.00 1.82 1.80 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.49 7.81 4 Q 7.92 4.00 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 5 I 7.92 3.68 2.02 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 1.41 0.78 0.91 0.00 0.00 6 E 8.47 4.03 0.00 2.07 2.04 0.00 0.00 0.00 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 2.40 0.00 7 D 7.69 4.35 0.00 3.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 3.99 0.00 1.76 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.66 1.63 7.81 9 L 7.76 4.31 0.00 1.98 1.72 0.92 0.85 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 10 E 7.61 4.10 0.00 2.09 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 2.37 2.32 0.00 11 E 8.13 4.07 0.00 2.06 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 2.40 2.37 0.00 12 I 8.35 3.74 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 1.41 0.65 0.90 0.00 0.00 13 L 7.57 4.02 0.00 1.78 1.91 0.72 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.98 4.70 0.00 4.09 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 8.02 4.02 0.00 1.82 1.90 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.68 7.81 16 L 7.81 4.07 0.00 1.57 1.61 0.86 0.80 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 17 Y 8.28 4.60 0.00 3.10 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 18 H 8.19 4.65 0.00 3.26 3.52 0.00 5.87 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 19 I 8.09 3.76 1.87 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 1.51 0.48 0.90 0.00 0.00 20 E 7.54 4.24 0.00 2.09 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 2.32 2.30 0.00 21 N 7.55 4.48 0.00 3.02 2.89 0.00 0.00 7.05 7.53 0.00 0.00 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 8.01 4.04 0.00 2.03 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 2.18 2.45 0.00 23 L 7.98 4.29 0.00 1.71 1.69 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.48 4.32 1.41 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 0.00 0.00 0.00 0.00 0.00 25 R 7.85 3.95 0.00 1.89 1.92 0.00 3.23 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 26 I 7.67 3.61 1.97 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 1.40 0.74 0.91 0.00 0.00 27 K 7.35 3.98 0.00 1.83 2.02 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.63 7.81 28 K 8.86 4.09 0.00 2.07 1.83 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.48 7.81 29 L 7.95 4.32 0.00 1.75 1.76 0.92 0.90 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 30 L 7.52 4.53 0.00 1.78 1.64 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.47 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00