NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4566 8.1727 122.0534 55.0643 34.0849 174.2476 3 V 4.4116 7.6883 121.0182 58.1980 33.7076 173.5224 4 R 4.5350 8.3307 124.1655 55.0242 33.1356 175.2261 5 A 3.8673 8.5473 120.7223 54.3286 18.4529 177.5804 6 S 4.5063 7.7035 110.8681 56.4749 61.7936 171.9736 7 V 4.0658 7.8375 124.7884 61.3004 32.4050 175.1982 8 K 4.5934 7.9385 124.8271 54.5915 36.2916 176.1681 9 R 4.1669 8.3496 118.9981 56.1034 29.4369 176.9485 10 I 3.9774 8.2870 125.0765 63.0340 38.0921 175.8820 11 C 5.1478 7.7397 118.3122 58.6534 29.9937 172.5852 12 D 4.8499 8.6778 118.2560 54.5483 40.9208 176.9720 13 K 4.2795 7.9615 116.8928 56.6619 32.5967 176.2793 14 C 4.4570 7.8292 120.3158 59.4170 32.4289 173.0046 15 K 4.3745 8.9848 126.5027 54.2085 34.2183 174.9409 16 V 4.0273 8.5303 127.3719 63.4588 31.5923 174.8267 17 I 4.5732 8.3635 128.4010 59.4625 40.7543 175.0505 18 R 5.2618 8.6336 124.6350 54.4129 29.8419 174.0270 19 R 4.5793 8.1638 119.1000 55.4456 31.9690 176.2890 20 H 4.0078 9.6805 116.5646 56.5284 26.0948 174.5052 21 G 4.1501 7.8915 108.8688 45.6902 0.0000 174.9951 22 R 4.1474 7.7751 117.6285 55.5741 31.3348 175.1689 23 V 4.4060 7.9295 118.7594 62.1406 32.8006 173.9086 24 Y 5.1290 8.3680 129.3121 58.5574 40.4231 174.7992 25 V 4.4499 7.8342 115.0086 63.4404 34.9634 172.3414 26 I 4.7447 8.0157 128.1686 60.1282 41.2867 174.3780 27 C 4.7593 8.1907 123.0558 58.8623 34.1190 171.9507 28 E 4.0098 9.1396 119.6964 58.4809 30.0751 176.6003 29 N 4.4432 7.8884 113.5743 51.9935 38.4002 174.3624 30 P 4.4766 0.0000 0.0000 64.0750 31.2781 177.7106 31 K 4.2483 7.7382 118.0623 58.6621 32.0372 177.1963 32 H 4.8613 7.8412 114.2781 55.1373 29.3838 174.2821 33 K 4.3984 7.6461 120.7040 57.1529 30.9532 176.0115 34 Q 5.3173 8.4811 124.8191 53.9744 31.5684 175.5112 35 R 4.1283 8.1319 122.1537 54.8255 32.4754 173.5246 36 Q 4.0962 8.4644 128.6133 56.5175 29.5775 176.9911 37 G 3.7286 8.4647 114.7803 46.5862 0.0000 172.4628 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 2 K 8.17 4.46 0.00 1.83 1.75 0.00 1.64 0.00 0.00 1.95 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.40 7.81 3 V 7.69 4.41 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.90 0.00 0.00 4 R 8.33 4.53 0.00 1.96 1.97 0.00 3.11 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 5 A 8.55 3.87 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 6 S 7.70 4.51 0.00 3.80 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.84 4.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.90 0.00 0.00 8 K 7.94 4.59 0.00 1.56 1.64 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.38 7.81 9 R 8.35 4.17 0.00 1.80 1.90 0.00 3.20 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 10 I 8.29 3.98 1.60 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.66 0.00 0.00 11 C 7.74 5.15 0.00 2.95 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 12 D 8.68 4.85 0.00 2.75 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.96 4.28 0.00 1.78 1.90 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.43 7.81 14 C 7.83 4.46 0.00 3.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.98 4.37 0.00 1.84 1.65 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.35 7.81 16 V 8.53 4.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 17 I 8.36 4.57 1.89 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 1.45 1.13 0.87 0.00 0.00 18 R 8.63 5.26 0.00 1.82 1.84 0.00 3.20 0.00 0.00 3.30 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 19 R 8.16 4.58 0.00 1.93 1.88 0.00 2.28 0.00 0.00 2.90 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.19 0.00 20 H 9.68 4.01 0.00 3.43 3.59 0.00 5.88 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.89 4.15 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 0.00 0.00 0.00 22 R 7.78 4.15 0.00 1.79 1.63 0.00 2.88 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 23 V 7.93 4.41 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 1.03 0.00 0.00 0.94 0.00 0.00 24 Y 8.37 5.13 0.00 2.83 2.95 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 25 V 7.83 4.45 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 1.00 0.00 0.00 0.96 0.00 0.00 26 I 8.02 4.74 1.88 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 1.10 0.47 0.92 0.00 0.00 27 C 8.19 4.76 0.00 2.97 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 28 E 9.14 4.01 0.00 1.97 1.81 0.00 0.00 0.00 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 2.24 0.00 29 N 7.89 4.44 0.00 2.93 2.90 0.00 0.00 5.73 7.76 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 30 P 0.00 4.48 0.00 2.24 2.33 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 31 K 7.74 4.25 0.00 1.85 1.87 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.38 7.81 32 H 7.84 4.86 0.00 3.10 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.65 4.40 0.00 2.00 1.81 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.48 7.81 34 Q 8.48 5.32 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.48 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 35 R 8.13 4.13 0.00 1.61 1.57 0.00 3.00 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.50 0.00 36 Q 8.46 4.10 0.00 2.12 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 37 G 8.46 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00