NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9840 8.2127 109.7414 45.4609 0.0000 173.3724 2 I 2.9431 8.3384 117.6359 63.1905 37.5741 173.7571 3 V 3.4783 8.3713 119.9388 66.0377 31.7197 177.1418 4 E 3.9225 8.0691 116.4934 59.5432 29.5891 178.7893 5 Q 4.1323 8.4219 119.6241 58.6035 29.0660 176.4455 6 C 5.2557 8.2566 115.4893 56.1511 41.5633 174.6187 7 C 4.4170 8.1300 117.5562 59.7286 28.4716 174.0146 8 T 4.3713 7.6927 110.3305 62.4271 70.2125 175.0985 9 S 4.7420 7.4798 115.8733 55.9274 66.6631 173.3012 10 I 4.1047 8.2732 124.2331 61.5401 37.3582 176.3771 11 C 4.8769 8.5831 123.4167 55.6049 38.8080 174.4465 12 S 4.4708 8.9148 119.8646 58.0711 64.6065 175.4827 13 L 4.0897 8.4671 121.9791 58.0784 41.0848 179.1558 14 Y 4.2887 8.0034 118.1385 60.9872 39.1168 177.7516 15 Q 3.9031 8.3230 118.9731 58.8871 28.8111 178.7321 16 L 4.2419 8.5264 120.5182 57.7436 41.7263 179.0034 17 E 4.2126 8.4188 119.4331 59.1702 29.2304 178.2204 18 N 4.2765 7.8215 115.8655 55.5520 38.9692 174.6789 19 Y 4.4302 7.9883 116.1963 57.9827 38.4622 175.4564 20 C 4.4881 7.6924 118.2099 59.3575 29.0284 173.5350 21 N 4.5399 8.5123 117.1814 53.7710 38.2678 175.5255 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 8.34 2.94 1.34 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.29 0.75 0.00 0.00 3 V 8.37 3.48 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 1.06 0.00 0.00 0.88 0.00 0.00 4 E 8.07 3.92 0.00 2.19 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 2.43 0.00 5 Q 8.42 4.13 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 6 C 8.26 5.26 0.00 2.89 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 7 C 8.13 4.42 0.00 3.10 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 7.69 4.37 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 1.27 0.00 0.00 9 S 7.48 4.74 0.00 3.99 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 8.27 4.10 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 1.41 0.47 0.92 0.00 0.00 11 C 8.58 4.88 0.00 2.96 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 12 S 8.91 4.47 0.00 4.13 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 8.47 4.09 0.00 1.78 1.82 0.95 0.70 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 8.00 4.29 0.00 2.86 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 15 Q 8.32 3.90 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 16 L 8.53 4.24 0.00 1.84 1.78 0.93 0.72 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 8.42 4.21 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 18 N 7.82 4.28 0.00 2.42 2.62 0.00 0.00 7.12 7.68 0.00 0.00 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 7.99 4.43 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 4.49 0.00 3.02 2.90 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 0.00 0.00 0.00 21 N 8.51 4.54 0.00 2.72 2.73 0.00 0.00 6.76 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