NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9728 8.2127 109.7409 45.4421 0.0000 173.5079 2 I 3.2440 8.1750 117.5142 63.1539 37.5124 173.7358 3 V 3.5215 8.3645 120.2249 66.0064 31.7036 177.3483 4 E 3.9690 8.0067 116.7500 59.2688 28.8991 178.6507 5 Q 4.1451 8.4343 119.8446 58.5846 29.0362 176.5150 6 C 5.1845 8.1076 115.2765 56.2286 41.6667 174.3050 7 C 4.1888 8.1484 117.7040 60.8308 28.6954 175.1382 8 T 4.1821 7.9068 109.2458 63.8245 69.0930 175.0518 9 S 4.6775 7.5134 112.9746 56.1156 67.1030 173.3848 10 I 3.8001 8.3121 124.2078 61.8416 37.2536 176.4745 11 C 4.9128 8.6033 123.3831 55.8517 42.0261 174.4478 12 S 4.5363 9.0267 119.6692 57.8580 64.8989 175.5356 13 L 3.9961 8.4391 122.0310 58.0197 41.0955 179.0427 14 Y 4.1232 8.0588 118.1618 60.9492 38.5203 177.8399 15 Q 4.0613 8.1445 118.4207 59.0569 28.7920 178.8921 16 L 4.3109 8.3116 120.1463 57.6790 41.6413 179.0921 17 E 4.0052 8.2722 119.2923 59.0870 29.2388 178.4659 18 N 4.1711 7.4047 114.7468 55.7357 38.5497 175.7591 19 Y 4.4202 7.7866 116.2342 57.5625 38.6002 175.5960 20 C 4.4129 7.2099 118.0646 59.3043 29.0554 173.2321 21 N 4.4904 8.5334 118.7802 54.0227 38.5819 174.8469 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 3.97 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 0.00 0.00 0.00 2 I 8.17 3.24 0.87 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.44 0.65 0.00 0.00 3 V 8.36 3.52 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 1.06 0.00 0.00 0.87 0.00 0.00 4 E 8.01 3.97 0.00 2.08 2.00 0.00 0.00 0.00 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 2.42 0.00 5 Q 8.43 4.15 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.63 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 6 C 8.11 5.18 0.00 3.02 3.07 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 7 C 8.15 4.19 0.00 3.09 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 9 S 7.51 4.68 0.00 3.88 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 8.31 3.80 1.89 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 8.60 4.91 0.00 2.99 3.07 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 12 S 9.03 4.54 0.00 4.12 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 8.44 4.00 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 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.06 4.12 0.00 2.92 3.01 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 0.00 0.00 0.00 15 Q 8.14 4.06 0.00 2.51 2.21 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 2.47 2.56 0.00 16 L 8.31 4.31 0.00 1.87 1.79 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.27 4.01 0.00 2.18 1.87 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 2.25 2.34 0.00 18 N 7.40 4.17 0.00 2.53 2.41 0.00 0.00 6.99 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 7.79 4.42 0.00 3.07 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 20 C 7.21 4.41 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 8.53 4.49 0.00 2.69 2.69 0.00 0.00 6.86 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