NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8405 8.3544 109.7372 45.6631 0.0000 173.3887 2 C 4.5642 8.3632 119.2194 51.9564 44.4162 170.9709 3 P 4.5014 0.0000 0.0000 63.4033 33.1606 177.0806 4 R 4.3315 8.2093 119.0145 55.5159 28.2360 177.0530 5 I 4.4822 7.0687 119.7776 58.8623 40.8562 174.8787 6 L 4.2586 8.4669 127.0100 54.7151 41.2227 176.6327 7 I 4.5973 8.3057 124.9474 59.1552 40.2722 175.6111 8 R 3.9557 8.5981 126.6580 56.3760 30.6220 175.1594 9 C 4.8961 8.6251 115.8725 54.4613 44.4018 173.4488 10 K 4.1871 9.6276 121.6830 56.9538 33.6743 175.8040 11 Q 4.7152 7.6835 114.4372 53.7179 32.1037 175.5420 12 D 4.3849 8.6355 117.6299 57.4715 40.8517 179.0344 13 S 4.3947 7.9431 111.6086 60.2275 63.1353 174.6962 14 D 4.4768 7.9355 120.4543 56.0070 40.8217 175.4153 15 C 4.9930 7.9567 116.5935 54.5443 44.1054 173.7083 16 L 4.2512 8.1084 120.8152 54.1256 41.9755 176.7894 17 A 4.1710 8.3137 123.6425 54.1182 18.5900 178.5741 18 G 3.9797 8.9518 109.2344 45.4087 0.0000 173.8903 19 C 5.2109 7.9038 116.2891 55.3587 44.0609 173.5074 20 V 4.6153 8.7629 113.8833 59.4422 35.5381 174.1506 21 C 4.7348 9.7028 123.8570 55.9626 39.0507 173.9642 22 G 3.9675 9.3617 116.6494 44.2465 0.0000 172.1964 23 P 4.3421 0.0000 0.0000 64.9855 31.3731 176.9255 24 N 4.7624 8.2924 114.9810 52.8385 38.7184 174.9038 25 G 3.8004 8.3060 106.4920 46.4101 0.0000 173.2833 26 F 5.1471 7.9020 116.3421 55.1403 43.0140 175.5175 27 C 4.9374 9.3056 120.0085 57.5403 37.4889 173.0202 28 G 4.0690 8.5730 107.8362 45.7740 0.0000 172.5654 29 S 4.8352 8.6648 116.2024 57.3482 63.8552 173.3472 30 P 4.4143 0.0000 0.0000 63.1120 31.3954 176.0266 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 G 8.35 3.84 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 0.00 0.00 0.00 2 C 8.36 4.56 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.23 2.04 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 4 R 8.21 4.33 0.00 1.85 1.80 0.00 3.21 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.18 0.00 5 I 7.07 4.48 1.89 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 1.45 1.39 0.93 0.00 0.00 6 L 8.47 4.26 0.00 1.72 1.79 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.31 4.60 1.92 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 1.37 0.90 0.91 0.00 0.00 8 R 8.60 3.96 0.00 1.50 1.50 0.00 3.19 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 9 C 8.63 4.90 0.00 3.05 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 10 K 9.63 4.19 0.00 1.61 1.91 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.31 7.81 11 Q 7.68 4.72 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.67 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 12 D 8.64 4.38 0.00 2.73 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 13 S 7.94 4.39 0.00 3.97 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 14 D 7.94 4.48 0.00 2.89 2.73 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 15 C 7.96 4.99 0.00 3.06 2.99 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 16 L 8.11 4.25 0.00 1.72 1.59 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.31 4.17 1.25 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 0.00 0.00 18 G 8.95 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 19 C 7.90 5.21 0.00 2.98 3.01 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 0.00 0.00 0.00 20 V 8.76 4.62 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.98 0.00 0.00 21 C 9.70 4.73 0.00 2.99 3.05 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 0.00 0.00 0.00 22 G 9.36 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 0.00 0.00 0.00 23 P 0.00 4.34 0.00 2.21 2.22 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 24 N 8.29 4.76 0.00 2.86 3.01 0.00 0.00 6.97 7.65 0.00 0.00 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 G 8.31 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.90 5.15 0.00 3.03 2.96 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 0.00 0.00 0.00 27 C 9.31 4.94 0.00 2.89 3.05 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 0.00 0.00 0.00 28 G 8.57 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.66 4.84 0.00 3.78 3.81 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 0.00 0.00 0.00 30 P 0.00 4.41 0.00 2.18 2.03 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00