NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0027 8.2127 109.7443 45.4745 0.0000 173.5553 2 I 3.3712 8.1278 117.5363 63.2005 37.6408 173.6075 3 V 3.5410 8.4289 120.1385 65.8868 32.0032 177.3131 4 E 4.4349 7.9776 119.2655 59.0624 29.1951 179.0307 5 Q 4.3016 7.8974 118.0931 57.1952 29.0212 176.7473 6 C 4.8617 8.4566 115.7196 56.9186 42.2342 174.4260 7 C 4.3988 7.7399 119.1117 61.3931 32.3631 174.8324 8 T 4.0322 8.4044 110.5406 63.4294 68.7255 174.0269 9 S 5.0681 7.4907 114.0663 55.4712 66.0155 173.0793 10 I 3.8041 8.0586 121.6592 61.3793 37.1752 177.1771 11 C 4.8175 8.5504 125.2958 56.3989 45.6573 172.5093 12 S 4.7955 8.0040 114.6093 55.9133 66.4172 174.8713 13 L 3.9967 8.5588 124.5696 58.3710 41.6528 178.5208 14 Y 3.9295 8.0573 118.2838 60.9972 39.1075 177.9216 15 Q 4.3161 8.1625 118.9257 58.8857 28.8641 178.4852 16 L 4.1794 8.1600 120.0673 58.0645 41.7570 179.4360 17 E 4.0819 8.3760 117.7255 58.7563 29.0959 178.8347 18 N 4.2661 7.7747 115.7210 55.1982 38.5541 175.1236 19 Y 4.5249 7.4911 115.9792 57.7585 38.6345 175.7140 20 C 4.4728 7.5110 117.7302 59.1962 29.0941 173.5129 21 N 4.5313 8.5380 117.8317 53.7683 38.2177 175.3833 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 8.13 3.37 0.75 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.31 0.64 0.00 0.00 3 V 8.43 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 1.03 0.00 0.00 0.88 0.00 0.00 4 E 7.98 4.43 0.00 2.30 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 7.90 4.30 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.68 2.50 0.00 6 C 8.46 4.86 0.00 3.03 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 7.74 4.40 0.00 2.90 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 8 T 8.40 4.03 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 7.49 5.07 0.00 4.05 3.99 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 10 I 8.06 3.80 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 8.55 4.82 0.00 3.11 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 8.00 4.80 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 8.56 4.00 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 8.06 3.93 0.00 3.06 2.98 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 15 Q 8.16 4.32 0.00 2.33 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.56 0.00 0.00 0.00 0.00 0.00 2.55 2.65 0.00 16 L 8.16 4.18 0.00 1.91 1.78 0.95 0.76 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 8.38 4.08 0.00 1.89 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 2.31 2.48 0.00 18 N 7.77 4.27 0.00 2.62 2.28 0.00 0.00 6.89 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 7.49 4.52 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.51 4.47 0.00 2.95 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 8.54 4.53 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