NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9801 8.2127 109.7406 45.5284 0.0000 173.6857 2 I 3.2430 8.2393 117.6691 63.1623 37.7436 173.9228 3 V 3.5043 8.3571 120.0521 65.9192 31.6866 177.1471 4 E 3.9687 8.0707 116.6329 59.7765 29.4468 179.0816 5 Q 4.2157 8.0783 116.5984 58.1357 28.8911 176.2842 6 C 5.1419 7.9101 112.7147 55.3414 42.1683 174.1766 7 C 4.2902 8.1502 116.3810 59.9798 28.8092 174.6762 8 T 4.2873 7.8531 108.8923 62.6966 69.6566 175.0602 9 S 4.7725 7.5171 115.9248 56.0104 66.7869 173.0545 10 I 3.8936 8.1920 123.7100 61.4710 37.4699 176.6633 11 C 4.7910 8.5678 123.0621 56.0574 41.4813 174.3830 12 S 4.5021 8.9730 119.5883 57.9620 64.7800 175.6026 13 L 4.0077 8.3938 121.5429 57.8455 41.0811 178.9956 14 Y 4.1993 8.0488 118.4161 60.8330 39.1379 177.7284 15 Q 3.9114 8.0773 118.7932 58.9770 28.8333 178.6716 16 L 4.1295 8.1465 120.1230 58.1884 41.8611 179.0824 17 E 3.8747 8.5024 119.2409 59.5420 29.1066 178.3500 18 N 4.0393 7.6145 115.8507 56.0935 38.8497 175.2481 19 Y 4.4098 7.5989 115.2903 57.0011 38.7382 175.6828 20 C 4.4153 7.1710 117.8479 59.5147 29.0004 173.5206 21 N 4.5357 8.5613 118.0949 53.7599 38.2152 175.3417 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 8.24 3.24 0.90 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.51 0.67 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 0.86 0.00 0.00 4 E 8.07 3.97 0.00 2.13 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 2.47 0.00 5 Q 8.08 4.22 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.65 2.66 0.00 6 C 7.91 5.14 0.00 3.02 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 7 C 8.15 4.29 0.00 3.11 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.29 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 7.52 4.77 0.00 3.85 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 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 0.47 0.92 0.00 0.00 11 C 8.57 4.79 0.00 2.97 3.04 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 0.00 0.00 0.00 0.00 12 S 8.97 4.50 0.00 4.12 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 13 L 8.39 4.01 0.00 1.77 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.05 4.20 0.00 2.94 3.06 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 15 Q 8.08 3.91 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.51 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 16 L 8.15 4.13 0.00 1.91 1.80 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.50 3.87 0.00 2.15 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 0.00 2.33 2.55 0.00 18 N 7.61 4.04 0.00 2.38 2.36 0.00 0.00 7.15 7.35 0.00 0.00 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 7.60 4.41 0.00 3.01 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 7.17 4.42 0.00 3.00 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