NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9807 8.2127 109.7453 45.0084 0.0000 174.4688 2 I 3.3452 8.1147 120.8732 62.2647 37.6707 172.9898 3 V 3.4912 8.4006 120.0116 66.1268 31.7296 177.0927 4 E 3.9702 8.1543 116.3420 59.6331 29.3499 178.8015 5 Q 4.1896 8.2929 118.7772 58.3673 29.3599 176.3102 6 C 5.1590 8.2071 114.9395 55.7625 41.8760 174.1476 7 C 4.3908 8.0866 117.5633 59.8156 28.2973 174.0504 8 T 4.6038 7.5789 107.8142 61.3069 70.0422 173.9077 9 S 4.6303 7.4345 116.8815 57.2608 66.8473 173.4997 10 I 3.9225 8.2195 124.7978 61.4160 37.4212 176.4101 11 C 4.8305 8.6274 123.4663 55.8489 42.3195 174.4704 12 S 4.5027 9.2375 120.2776 58.0065 64.8504 175.4513 13 L 4.0533 8.4818 122.0222 58.0019 41.0531 179.2568 14 Y 4.0287 7.9712 118.3809 60.8484 39.1766 177.5309 15 Q 4.1662 8.4097 118.9817 59.0816 28.7648 178.8972 16 L 4.3667 8.1716 119.7579 57.5740 41.6130 179.1545 17 E 3.9221 8.1329 118.5474 59.3220 29.0452 178.9104 18 N 4.1917 7.7317 115.7874 55.7975 38.2264 175.7727 19 Y 4.4491 7.8982 116.5889 57.2043 38.1608 175.3414 20 C 4.3770 7.2170 118.3609 59.1286 29.1381 173.5276 21 N 4.5278 8.5134 117.3821 53.8023 38.1764 175.4427 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 8.11 3.35 1.08 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.27 0.70 0.00 0.00 3 V 8.40 3.49 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 1.00 0.00 0.00 0.88 0.00 0.00 4 E 8.15 3.97 0.00 2.18 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 2.33 2.45 0.00 5 Q 8.29 4.19 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 6 C 8.21 5.16 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 8.09 4.39 0.00 3.08 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 7.58 4.60 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 7.43 4.63 0.00 3.87 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 3.92 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 0.93 0.00 0.00 11 C 8.63 4.83 0.00 2.99 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 9.24 4.50 0.00 4.10 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 8.48 4.05 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 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.97 4.03 0.00 2.96 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 15 Q 8.41 4.17 0.00 2.41 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 16 L 8.17 4.37 0.00 1.91 1.80 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.13 3.92 0.00 2.03 1.88 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 2.30 2.53 0.00 18 N 7.73 4.19 0.00 2.49 2.39 0.00 0.00 6.97 7.58 0.00 0.00 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 7.90 4.45 0.00 3.19 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 7.22 4.38 0.00 3.03 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.51 4.53 0.00 2.71 2.73 0.00 0.00 6.78 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