NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9984 8.2127 109.7442 45.4088 0.0000 173.5054 2 I 3.3233 8.1099 117.5341 63.2648 37.5219 173.4429 3 V 3.5427 8.4183 120.0864 65.9553 31.4536 177.3218 4 E 4.2563 7.9842 119.2667 58.9306 29.1831 178.9588 5 Q 3.9249 7.9943 116.8675 57.7833 29.0627 176.6893 6 C 4.8743 8.4825 115.6402 56.8542 42.2504 174.3552 7 C 4.4065 7.7539 119.0778 61.3645 32.3652 174.8671 8 T 4.0450 8.2444 110.2467 63.3509 68.6924 173.9984 9 S 5.1028 7.1897 114.5305 55.5320 65.9952 173.4799 10 I 3.7909 8.0764 121.6936 61.2788 37.1415 177.1753 11 C 4.8012 8.5761 125.4632 56.5013 45.6947 172.5679 12 S 4.8076 8.0352 115.2966 55.8377 66.5605 174.8134 13 L 3.9851 8.5685 124.5880 58.3679 41.6556 178.4905 14 Y 3.9377 8.0701 118.2150 60.9940 39.0031 177.9471 15 Q 4.3110 8.1394 118.8458 58.9496 28.7860 178.5242 16 L 4.1595 8.1383 120.0240 58.1174 41.6537 179.4664 17 E 4.0170 8.3056 117.5693 58.7163 29.0801 178.8542 18 N 4.1932 7.8123 115.9738 55.2189 38.5638 175.1500 19 Y 4.5013 7.5712 116.0973 57.7746 38.5782 175.6669 20 C 4.4746 7.4268 118.3139 59.2328 29.1463 173.5169 21 N 4.5274 8.5298 117.8305 53.7294 38.2652 175.4022 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 8.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.11 3.32 0.66 0.00 0.00 0.39 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 1.32 0.63 0.00 0.00 3 V 8.42 3.54 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 1.08 0.00 0.00 0.88 0.00 0.00 4 E 7.98 4.26 0.00 2.28 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 2.41 2.32 0.00 5 Q 7.99 3.92 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 6 C 8.48 4.87 0.00 3.02 3.09 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 0.00 0.00 0.00 0.00 7 C 7.75 4.41 0.00 2.90 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.24 4.04 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.19 5.10 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.08 3.79 1.88 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 1.30 0.54 0.92 0.00 0.00 11 C 8.58 4.80 0.00 3.12 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 12 S 8.04 4.81 0.00 4.10 3.93 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 0.00 0.00 0.00 13 L 8.57 3.99 0.00 1.81 1.76 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.07 3.94 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 15 Q 8.14 4.31 0.00 2.34 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.55 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 16 L 8.14 4.16 0.00 1.91 1.78 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.31 4.02 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 18 N 7.81 4.19 0.00 2.53 2.28 0.00 0.00 6.89 7.59 0.00 0.00 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 Y 7.57 4.50 0.00 3.11 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 C 7.43 4.47 0.00 2.90 2.85 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 21 N 8.53 4.53 0.00 2.71 2.72 0.00 0.00 6.80 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00