NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9763 8.2127 109.7458 45.0488 0.0000 174.5533 2 I 3.1446 7.9042 119.5204 62.7852 37.8064 172.9892 3 V 3.4967 8.3561 120.0525 66.0070 31.6642 177.2803 4 E 3.9668 8.0098 116.6522 59.4390 29.4720 178.5787 5 Q 4.2386 8.0486 118.1962 57.7758 29.2895 175.5518 6 C 5.0992 8.2881 114.3675 56.8853 41.5023 173.8750 7 C 4.6008 7.9986 116.1630 59.8204 28.1048 173.5653 8 T 4.4198 7.9430 114.5683 64.7702 70.3170 174.1186 9 S 4.7929 7.7133 115.1840 56.1131 65.0277 174.2531 10 I 3.7663 8.3140 125.8000 61.7934 37.3327 176.2495 11 C 4.8482 8.6210 123.2563 55.9253 42.1655 174.4771 12 S 4.5156 8.5025 119.7602 58.0918 64.5648 175.5015 13 L 3.9961 8.5328 122.9929 58.1034 41.4696 178.9835 14 Y 4.3247 8.0559 119.0928 60.9574 38.8541 178.0296 15 Q 3.8866 8.4380 119.2365 58.9229 28.7602 178.7823 16 L 4.3156 8.3195 120.0004 57.5560 41.6110 179.1003 17 E 4.0265 7.8996 118.3957 58.6626 29.0681 178.6253 18 N 4.2261 7.7885 115.9248 55.2283 38.4630 175.1092 19 Y 4.5002 7.3160 116.3586 57.7554 38.3330 175.5584 20 C 4.4984 7.5365 118.2295 59.0578 29.2303 173.5671 21 N 4.5318 8.5219 117.6368 53.7653 38.2394 175.4245 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 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 2 I 7.90 3.14 0.56 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.03 0.61 0.00 0.00 3 V 8.36 3.50 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 8.01 3.97 0.00 2.12 2.01 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 2.32 2.42 0.00 5 Q 8.05 4.24 0.00 2.24 2.20 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 2.46 2.50 0.00 6 C 8.29 5.10 0.00 3.01 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 7 C 8.00 4.60 0.00 3.09 2.92 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 0.00 0.00 0.00 8 T 7.94 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 7.71 4.79 0.00 3.84 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 10 I 8.31 3.77 1.89 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 0.47 0.93 0.00 0.00 11 C 8.62 4.85 0.00 3.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.52 0.00 4.08 4.06 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 0.00 0.00 0.00 0.00 13 L 8.53 4.00 0.00 1.70 1.84 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.06 4.32 0.00 3.03 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 15 Q 8.44 3.89 0.00 2.42 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 16 L 8.32 4.32 0.00 1.88 1.81 0.96 1.05 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 7.90 4.03 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 18 N 7.79 4.23 0.00 2.08 2.27 0.00 0.00 6.90 7.51 0.00 0.00 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 7.32 4.50 0.00 3.12 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 20 C 7.54 4.50 0.00 3.03 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 8.52 4.53 0.00 2.72 2.72 0.00 0.00 6.79 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