NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9493 8.3544 109.7401 45.6725 0.0000 176.0884 2 I 3.9888 8.3716 124.6351 61.9643 38.0522 171.6631 3 V 3.5793 8.4652 114.3941 64.4945 31.4172 177.5384 4 E 3.9745 8.1997 118.9058 58.8580 28.9249 179.2176 5 Q 3.9725 8.2356 118.0652 58.4463 29.0636 176.7839 6 C 4.9899 7.7758 116.7977 57.4659 41.7981 174.6306 7 C 4.1733 7.8190 119.0484 61.7149 32.1570 174.7192 8 T 4.0603 9.0575 118.0809 65.6009 68.4513 174.3877 9 S 5.0056 7.4206 113.8333 55.7835 66.0840 173.1817 10 I 4.0590 7.6877 120.8066 61.3334 37.3870 175.1103 11 C 4.9014 8.4868 123.4518 54.9718 44.1447 173.0858 12 S 4.7050 8.0809 120.4405 56.2973 64.8203 174.8529 13 L 3.8879 8.3869 122.5540 57.7706 41.8381 177.0300 14 Y 4.7952 7.6776 113.9563 58.3784 39.4769 177.5599 15 Q 4.3739 7.8599 117.7013 58.5186 28.5001 178.2145 16 L 4.4242 8.0369 119.4848 57.0745 41.8012 178.3734 17 E 3.7612 8.2059 117.5300 58.6644 29.4259 178.2968 18 N 4.4673 7.6851 115.5494 55.0122 38.7639 175.2166 19 Y 4.4343 8.5727 117.2314 57.9214 38.5098 175.3595 20 C 4.6051 7.6884 117.6762 58.6291 29.7132 173.3496 21 N 4.5435 8.5770 118.2509 53.7467 38.2307 175.3150 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 3.95 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 0.00 0.00 0.00 2 I 8.37 3.99 1.95 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.02 0.88 0.00 0.00 3 V 8.47 3.58 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 0.82 0.00 0.00 0.92 0.00 0.00 4 E 8.20 3.97 0.00 2.02 2.03 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 2.41 2.28 0.00 5 Q 8.24 3.97 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.61 2.73 0.00 6 C 7.78 4.99 0.00 2.81 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 7 C 7.82 4.17 0.00 2.88 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 9.06 4.06 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 9 S 7.42 5.01 0.00 3.87 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 4.06 1.87 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 1.18 0.53 0.90 0.00 0.00 11 C 8.49 4.90 0.00 2.87 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 12 S 8.08 4.70 0.00 3.95 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 3.89 0.00 1.40 1.41 0.71 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.68 4.80 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 15 Q 7.86 4.37 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 16 L 8.04 4.42 0.00 1.72 1.77 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.21 3.76 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 3.10 0.00 18 N 7.69 4.47 0.00 2.15 2.48 0.00 0.00 6.91 7.34 0.00 0.00 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 8.57 4.43 0.00 3.06 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 20 C 7.69 4.61 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.58 4.54 0.00 2.73 2.74 0.00 0.00 6.81 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