NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.2577 8.1600 109.1404 45.1470 0.0000 174.5971 2 I 3.0398 8.0477 119.4071 62.9500 37.4373 172.6940 3 V 3.5117 8.4611 119.9106 66.2221 31.6985 177.2728 4 E 3.9741 8.0550 117.6414 59.4351 29.2123 178.8818 5 Q 4.2815 7.9955 116.3512 57.4298 29.0564 175.9556 6 C 5.1934 7.9160 113.6899 55.6282 41.8357 173.9893 7 C 4.6650 7.8468 116.2103 59.7407 28.0931 174.2533 8 T 4.4201 7.9483 115.6962 64.1494 70.9627 174.1814 9 S 4.7487 7.6495 114.6116 55.7999 64.8711 172.9176 10 I 3.8904 8.2901 128.1882 61.6019 37.3887 176.2387 11 C 4.8013 8.5770 123.2373 56.0010 40.6895 174.4294 12 S 4.5511 8.4474 119.6154 57.6458 65.0059 175.3449 13 L 4.0115 8.5155 121.7782 58.4106 41.0420 179.2977 14 Y 4.1624 7.9933 117.9359 60.6434 39.1728 177.3115 15 Q 3.4743 7.6609 118.0901 58.5526 28.7435 178.4786 16 L 4.1782 7.9810 120.1483 57.7510 41.7379 178.9595 17 E 4.0427 8.0427 118.1835 58.4643 29.3211 178.0721 18 N 4.3529 7.6502 114.7657 55.3436 38.5086 174.9733 19 Y 4.5541 7.5786 116.8797 57.7334 38.3318 175.6896 20 C 4.4441 7.6596 118.0666 59.4006 28.9766 173.5762 21 N 4.5376 8.5585 118.1054 53.7568 38.2213 175.3418 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 8.16 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 3.04 0.72 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.63 0.65 0.00 0.00 3 V 8.46 3.51 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 0.98 0.00 0.00 0.87 0.00 0.00 4 E 8.05 3.97 0.00 2.25 1.98 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 2.40 2.45 0.00 5 Q 8.00 4.28 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.66 0.00 6 C 7.92 5.19 0.00 2.94 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 7 C 7.85 4.66 0.00 3.10 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 4.42 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 7.65 4.75 0.00 3.81 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 3.89 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 1.42 0.65 0.92 0.00 0.00 11 C 8.58 4.80 0.00 2.96 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 12 S 8.45 4.55 0.00 4.11 4.09 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 13 L 8.52 4.01 0.00 1.78 1.83 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.99 4.16 0.00 2.97 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 15 Q 7.66 3.47 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 16 L 7.98 4.18 0.00 1.91 1.76 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.04 4.04 0.00 2.22 2.07 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 2.30 2.36 0.00 18 N 7.65 4.35 0.00 2.00 2.29 0.00 0.00 6.89 7.75 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 19 Y 7.58 4.55 0.00 2.92 2.93 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 20 C 7.66 4.44 0.00 3.05 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 21 N 8.56 4.54 0.00 2.72 2.73 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