NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9584 8.2127 109.7389 45.4256 0.0000 173.5490 2 I 2.9814 8.1410 119.4400 62.5573 37.6530 173.4755 3 V 3.5125 8.4647 119.9027 66.2470 31.5447 177.2851 4 E 3.9757 8.0082 117.5347 59.5543 29.2097 179.2224 5 Q 4.0279 8.2345 117.2542 58.3504 28.9050 177.0721 6 C 4.8959 8.5061 114.9192 56.6076 42.2100 174.2650 7 C 4.4475 7.8259 118.7327 61.2775 32.6312 174.8978 8 T 4.0693 8.3466 115.2850 66.4438 68.6910 174.7675 9 S 4.6506 7.8859 118.6238 57.4923 63.5569 172.6519 10 I 4.7468 8.1330 111.3980 59.3378 40.3063 173.4430 11 C 5.1151 8.2986 115.2413 52.9011 41.1582 174.3336 12 S 4.5482 8.5275 116.7743 57.6929 65.2097 175.3741 13 L 4.0959 8.2409 121.0906 57.8482 40.9944 179.0592 14 Y 4.0981 7.7011 115.6371 61.4428 38.1203 178.5583 15 Q 4.2082 8.1810 118.6445 58.9593 28.9037 178.5589 16 L 4.5404 8.5250 120.1640 57.6474 41.5987 178.8313 17 E 4.2514 8.0032 117.0578 57.8169 29.3160 178.2261 18 N 4.2228 8.3177 116.8453 55.2436 38.4829 175.0241 19 Y 4.3643 7.3560 117.1655 57.6042 38.3520 175.2319 20 C 4.5113 7.7717 118.2693 59.2245 29.0372 173.6096 21 N 4.5331 8.5954 118.7063 53.7414 38.1630 175.2106 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 3.96 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 0.00 0.00 0.00 2 I 8.14 2.98 0.56 0.00 0.00 0.54 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 1.23 0.64 0.00 0.00 3 V 8.46 3.51 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 0.91 0.00 0.00 0.86 0.00 0.00 4 E 8.01 3.98 0.00 2.23 1.98 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 2.40 2.45 0.00 5 Q 8.23 4.03 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.75 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 6 C 8.51 4.90 0.00 2.93 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 7.83 4.45 0.00 2.87 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 8 T 8.35 4.07 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.89 4.65 0.00 3.82 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 8.13 4.75 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 1.48 0.87 0.92 0.00 0.00 11 C 8.30 5.12 0.00 3.20 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 4.55 0.00 4.16 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.24 4.10 0.00 1.44 1.60 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.70 4.10 0.00 3.03 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 15 Q 8.18 4.21 0.00 2.43 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 16 L 8.53 4.54 0.00 1.76 1.80 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.00 4.25 0.00 2.22 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 2.31 2.51 0.00 18 N 8.32 4.22 0.00 2.04 2.26 0.00 0.00 6.86 7.48 0.00 0.00 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 7.36 4.36 0.00 3.07 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 20 C 7.77 4.51 0.00 3.01 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 8.60 4.53 0.00 2.72 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