NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0145 8.3544 109.7405 44.2605 0.0000 174.6624 2 I 3.8565 7.2485 117.3316 60.1067 39.9458 172.7669 3 V 3.4386 7.6472 118.9018 66.0212 31.8482 177.1031 4 E 3.4854 8.0977 117.2529 59.0389 29.4491 177.9603 5 Q 4.1522 7.9464 118.4286 58.4414 29.4751 177.4066 6 C 4.7075 8.2321 116.3211 57.5162 40.6154 174.2655 7 C 4.5745 8.4496 120.9576 59.2551 31.1924 173.5490 8 T 4.4922 7.9449 108.3925 62.6148 70.0611 175.4189 9 S 4.4999 7.5292 114.2032 57.4004 64.8355 169.8418 10 I 3.2618 7.5441 128.9153 60.9875 37.3598 173.4211 11 C 4.6188 8.5979 122.3305 56.4028 42.2057 173.4341 12 S 4.6546 8.6309 116.6540 57.1122 64.2715 175.0379 13 L 3.8315 8.5086 122.4790 58.9031 41.3493 178.9439 14 Y 4.2065 7.5402 114.4030 60.9471 38.0674 177.9477 15 Q 4.2658 8.2999 119.3709 58.7599 28.8727 178.4089 16 L 4.4841 8.0020 119.6044 57.6184 41.6910 178.9939 17 E 4.0283 8.0927 118.8796 59.5566 29.1557 178.8782 18 N 4.2578 7.5755 114.1293 56.2503 38.5981 176.1165 19 Y 4.3789 7.5487 115.6554 57.8137 38.6045 175.3855 20 C 4.2569 7.6501 120.6256 59.5527 32.3701 172.8448 21 N 4.5300 8.5289 120.0219 53.6632 38.5748 174.5523 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 8.35 4.01 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 0.00 0.00 0.00 2 I 7.25 3.86 1.37 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 1.02 0.07 0.76 0.00 0.00 3 V 7.65 3.44 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 0.89 0.00 0.00 0.87 0.00 0.00 4 E 8.10 3.49 0.00 1.99 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 2.29 2.37 0.00 5 Q 7.95 4.15 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 6 C 8.23 4.71 0.00 2.97 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 7 C 8.45 4.57 0.00 2.86 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 8 T 7.94 4.49 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 1.23 0.00 0.00 9 S 7.53 4.50 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 3.26 1.87 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 1.29 0.35 0.91 0.00 0.00 11 C 8.60 4.62 0.00 2.97 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 8.63 4.65 0.00 4.12 4.05 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 0.00 0.00 0.00 0.00 13 L 8.51 3.83 0.00 1.52 1.15 0.76 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.54 4.21 0.00 3.12 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 8.30 4.27 0.00 2.48 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 16 L 8.00 4.48 0.00 1.85 1.78 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.09 4.03 0.00 2.21 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 0.00 2.35 2.36 0.00 18 N 7.58 4.26 0.00 2.07 2.50 0.00 0.00 6.97 7.33 0.00 0.00 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 7.55 4.38 0.00 3.16 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 20 C 7.65 4.26 0.00 2.98 2.88 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 0.00 0.00 0.00 21 N 8.53 4.53 0.00 2.73 2.68 0.00 0.00 6.86 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