NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3561 8.3444 121.7169 56.0024 30.3392 174.0687 2 V 4.2881 7.9055 121.8931 59.7970 34.6788 169.4246 3 V 3.6548 8.6497 127.1570 64.2289 32.6180 175.5479 4 G 4.0000 9.0811 114.3971 45.4919 0.0000 172.4621 5 W 4.6314 7.7526 128.7520 54.3519 33.0776 173.6848 6 P 2.9700 0.0000 0.0000 61.0695 31.4228 175.4687 7 P 4.5545 0.0000 0.0000 61.9302 29.4644 175.6834 8 V 4.4445 7.2056 118.1283 60.5455 35.8017 175.8752 9 R 4.2654 8.2585 118.7561 56.2240 30.6483 176.9928 10 N 4.1582 7.9576 115.4764 53.6303 39.0040 174.3909 11 Y 4.4540 8.0808 119.5644 58.1551 38.6768 176.3887 12 R 4.3049 8.4748 121.8365 55.9605 31.1887 176.9845 13 K 4.1974 8.4408 118.9219 56.6820 32.6459 176.2231 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 Q 8.34 4.36 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 2 V 7.91 4.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.92 0.00 0.00 3 V 8.65 3.65 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.96 0.00 0.00 4 G 9.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 W 7.75 4.63 0.00 3.31 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 6 P 0.00 2.97 0.00 1.68 1.32 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.86 0.00 7 P 0.00 4.55 0.00 2.03 1.92 0.00 2.67 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 8 V 7.21 4.44 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.88 0.00 0.00 9 R 8.26 4.27 0.00 1.70 1.85 0.00 3.17 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 10 N 7.96 4.16 0.00 2.65 2.77 0.00 0.00 7.00 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.08 4.45 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.47 4.30 0.00 1.84 1.88 0.00 3.18 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 13 K 8.44 4.20 0.00 1.71 1.67 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.43 7.81