NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Y 5.2440 8.0916 117.7656 58.5054 38.6064 175.3250 2 K 4.6253 8.3039 130.5205 53.2679 31.5371 175.7615 3 F 4.5627 8.5410 125.0940 57.4649 43.2965 172.6745 4 A 5.9400 8.0415 127.5623 49.1604 20.9439 175.6291 5 C 4.3312 8.7407 118.3415 58.9865 28.9097 173.3805 6 P 4.3188 0.0000 0.0000 64.8884 31.5874 176.8992 7 E 4.3434 8.0752 120.5502 57.4912 30.4558 175.3224 8 C 5.0088 7.9578 111.0998 55.8572 31.8565 171.5807 9 P 4.5528 0.0000 0.0000 63.0022 31.8385 176.4036 10 K 3.9427 8.0701 120.0835 57.4263 33.0425 175.5562 11 R 4.9725 8.5682 121.6458 55.1801 30.9690 176.0573 12 F 4.8211 9.6622 124.3654 56.3963 41.5040 176.3580 13 M 3.6240 8.9902 117.9393 57.5253 32.7631 176.2910 14 R 4.5162 7.1331 115.1274 53.1048 34.5632 175.6638 15 S 2.7900 8.0670 114.1577 61.1157 62.0816 176.3397 16 D 4.2123 7.6915 121.1231 56.7757 38.3763 177.9884 17 H 4.2547 7.9818 117.1814 58.2314 28.0175 177.4046 18 L 3.3345 7.2594 119.8503 57.0227 41.8249 178.5582 19 S 4.3175 7.9208 113.3095 61.6131 61.9963 176.2305 20 K 4.0526 7.7037 120.3748 59.1837 32.2518 177.8845 21 H 4.4999 7.7421 119.3532 58.5756 29.6882 177.3132 22 I 3.9036 9.1531 115.7777 64.4319 37.2661 178.0346 23 T 3.3149 7.2510 114.0713 63.9844 67.2398 174.7913 24 L 4.4294 7.6783 120.3364 57.9738 40.9796 178.1074 25 H 4.7679 8.8744 121.5798 58.1463 29.5204 176.7593 26 E 4.3238 8.8129 122.8611 58.3061 29.4513 176.9018 27 L 4.3687 7.1996 114.9038 55.0537 42.9372 178.4507 28 L 4.7892 8.8467 120.4519 54.3143 43.3309 175.9520 29 G 4.3214 8.1945 104.5135 44.2944 0.0000 172.2234 30 E 4.7556 8.1160 129.7444 55.7458 30.7756 175.5782 31 E 4.7003 8.0703 117.4141 54.5064 32.0413 176.2525 32 R 4.5644 8.2950 119.1988 54.8471 31.3746 176.2982 33 R 4.0812 8.2191 119.8673 56.8720 30.0004 174.3209 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 Y 8.09 5.24 0.00 2.99 3.13 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 0.00 0.00 0.00 0.00 2 K 8.30 4.63 0.00 1.87 1.77 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.56 7.81 3 F 8.54 4.56 0.00 3.18 2.87 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 4 A 8.04 5.94 1.22 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 0.00 0.00 0.00 5 C 8.74 4.33 0.00 3.16 3.03 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 0.00 0.00 0.00 6 P 0.00 4.32 0.00 2.18 2.17 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.96 0.00 7 E 8.08 4.34 0.00 2.56 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 2.27 2.23 0.00 8 C 7.96 5.01 0.00 3.16 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.55 0.00 2.21 2.22 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 10 K 8.07 3.94 0.00 1.83 1.56 0.00 1.51 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.36 7.81 11 R 8.57 4.97 0.00 1.95 2.03 0.00 2.94 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 12 F 9.66 4.82 0.00 3.04 3.19 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 0.00 13 M 8.99 3.62 0.00 1.74 1.88 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 2.08 0.00 14 R 7.13 4.52 0.00 1.46 1.63 0.00 2.93 0.00 0.00 2.88 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 15 S 8.07 2.79 0.00 2.72 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 7.69 4.21 0.00 2.87 2.83 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 0.00 0.00 0.00 0.00 17 H 7.98 4.25 0.00 3.54 3.76 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.26 3.33 0.00 1.68 1.34 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.92 4.32 0.00 3.80 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 20 K 7.70 4.05 0.00 1.81 1.84 0.00 1.86 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.45 7.81 21 H 7.74 4.50 0.00 3.78 3.57 0.00 5.66 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 22 I 9.15 3.90 1.91 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 1.42 0.85 1.00 0.00 0.00 23 T 7.25 3.31 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 1.28 0.00 0.00 24 L 7.68 4.43 0.00 1.94 1.89 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.87 4.77 0.00 3.03 3.21 0.00 5.82 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.81 4.32 0.00 1.85 1.96 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 0.00 2.29 2.21 0.00 27 L 7.20 4.37 0.00 1.78 1.57 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.85 4.79 0.00 1.76 1.82 0.98 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.19 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.12 4.76 0.00 1.91 1.88 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 2.21 2.31 0.00 31 E 8.07 4.70 0.00 1.99 1.92 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 2.24 2.22 0.00 32 R 8.30 4.56 0.00 1.90 1.92 0.00 3.05 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 33 R 8.22 4.08 0.00 1.67 1.71 0.00 3.06 0.00 0.00 3.09 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.53 0.00