NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.4401 8.3544 109.7384 46.4732 0.0000 171.6748 2 I 2.9281 8.5336 127.7706 60.7598 35.7341 170.0338 3 V 3.5010 8.6426 120.5057 65.8855 31.7606 177.1240 4 E 3.9362 8.0866 117.8732 59.5084 28.8415 179.0475 5 Q 3.8217 7.9685 118.7671 59.2439 29.2599 177.9735 6 C 5.0343 8.5024 116.1769 56.8271 40.8687 174.0954 7 C 4.2319 7.8944 117.2854 60.1598 28.7120 174.5660 8 T 4.3575 7.2805 109.4578 62.2555 69.5214 174.9398 9 S 4.6514 7.6349 114.5585 56.0023 66.1587 173.3246 10 I 3.9081 8.2904 122.8535 61.9107 37.1229 176.4594 11 C 4.8400 8.5708 123.5878 55.7571 38.0674 174.4495 12 S 4.3818 8.7067 119.5140 57.8827 64.7616 175.5498 13 L 3.9915 8.0056 121.3574 57.7677 39.7030 179.0595 14 Y 4.6026 7.5378 116.0184 60.4881 37.9341 177.6613 15 Q 4.2890 8.1500 118.5245 58.7794 28.9907 178.2662 16 L 4.4489 8.0285 120.0778 57.3371 41.6278 178.7458 17 E 3.9715 8.5441 119.0326 59.9373 29.1825 179.0143 18 N 4.1392 7.3594 113.3777 56.3443 38.6457 175.9435 19 Y 4.5189 7.8117 114.7926 57.3591 38.7519 175.6797 20 C 4.4811 7.3554 119.1313 59.7852 29.0512 173.4453 21 N 4.4260 8.4368 119.3633 53.5820 36.3273 174.2576 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 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 2.93 0.99 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.23 0.68 0.00 0.00 3 V 8.64 3.50 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 0.99 0.00 0.00 0.87 0.00 0.00 4 E 8.09 3.94 0.00 2.10 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 2.40 2.43 0.00 5 Q 7.97 3.82 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 6 C 8.50 5.03 0.00 3.01 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 7 C 7.89 4.23 0.00 3.16 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 7.28 4.36 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 7.63 4.65 0.00 4.00 3.94 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 10 I 8.29 3.91 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.53 0.89 0.00 0.00 11 C 8.57 4.84 0.00 2.98 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 8.71 4.38 0.00 3.90 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 13 L 8.01 3.99 0.00 0.99 1.62 0.78 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.54 4.60 0.00 2.98 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 15 Q 8.15 4.29 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.02 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 16 L 8.03 4.45 0.00 1.93 1.80 0.93 0.95 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 8.54 3.97 0.00 2.22 2.08 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 2.58 2.67 0.00 18 N 7.36 4.14 0.00 2.24 2.33 0.00 0.00 7.03 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 7.81 4.52 0.00 3.09 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 7.36 4.48 0.00 2.95 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.44 4.43 0.00 2.80 2.74 0.00 0.00 5.95 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