NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9770 8.3544 109.7437 45.9606 0.0000 172.3382 2 I 4.0687 7.7019 114.4838 60.3384 43.5763 171.4399 3 V 3.4459 7.8743 119.2975 65.4344 32.1639 176.9700 4 E 3.9152 8.0308 118.1386 59.3276 29.6636 178.4402 5 Q 4.1391 8.0328 115.6791 58.6911 29.2715 177.9067 6 C 4.6134 7.5489 117.6859 58.5589 40.9375 174.6235 7 C 4.2454 8.4302 117.7716 60.7000 31.1902 174.0773 8 T 4.2264 7.6607 113.6960 64.6977 67.5209 176.2588 9 S 4.6067 7.2712 115.6418 58.0523 64.6619 172.0399 10 I 3.5199 7.6826 124.2803 61.2752 37.2251 172.8622 11 C 4.8207 8.3334 120.1670 55.1727 37.9247 173.4555 12 S 4.4886 8.3116 115.0492 57.5813 63.1508 174.4742 13 L 3.8397 8.4658 126.5034 58.7759 41.4711 179.1659 14 Y 4.3217 7.4282 114.3344 60.8612 37.9416 178.0014 15 Q 4.1775 8.0382 119.4135 58.8638 28.7730 178.4745 16 L 4.2822 7.9296 119.6081 57.7892 41.7325 179.0768 17 E 3.9792 8.1214 118.0677 59.2872 29.1254 178.7887 18 N 4.3818 7.6393 115.2209 54.9434 38.6431 175.1606 19 Y 4.6559 7.5198 116.4547 57.6887 39.0417 175.6363 20 C 4.3937 7.5775 120.3482 59.0398 32.3914 172.7450 21 N 4.5898 8.5333 122.1199 53.7601 38.8154 174.0177 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 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 7.70 4.07 0.89 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.49 0.68 0.00 0.00 3 V 7.87 3.45 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 1.03 0.00 0.00 0.85 0.00 0.00 4 E 8.03 3.92 0.00 1.98 1.95 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 2.28 2.31 0.00 5 Q 8.03 4.14 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.03 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 6 C 7.55 4.61 0.00 2.90 3.14 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 7 C 8.43 4.25 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 4.23 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 1.30 0.00 0.00 9 S 7.27 4.61 0.00 3.84 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.52 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 0.21 0.91 0.00 0.00 11 C 8.33 4.82 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 8.31 4.49 0.00 3.90 3.88 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 13 L 8.47 3.84 0.00 1.56 1.08 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.43 4.32 0.00 3.02 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.18 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 16 L 7.93 4.28 0.00 1.86 1.79 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.12 3.98 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 2.49 2.56 0.00 18 N 7.64 4.38 0.00 2.05 2.43 0.00 0.00 6.88 7.30 0.00 0.00 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 7.52 4.66 0.00 3.10 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 20 C 7.58 4.39 0.00 2.96 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 21 N 8.53 4.59 0.00 2.70 2.63 0.00 0.00 6.90 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