NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.4136 8.3448 120.8556 56.3220 31.3398 175.8908 2 C 4.1577 8.3271 118.2244 56.7195 35.0323 173.5987 3 C 4.5709 8.4648 126.9224 57.6869 32.9954 172.9870 4 N 5.0403 7.1337 117.8705 50.4802 38.7705 174.7398 5 P 4.2354 0.0000 0.0000 65.0019 32.6588 176.8672 6 A 4.7005 7.9543 119.7320 53.3583 20.2998 176.2245 7 C 4.4839 8.9553 116.7255 56.6359 39.0857 176.5557 8 G 3.8342 7.6566 106.1952 48.8943 0.0000 175.4550 9 R 4.1617 6.9487 116.6727 54.5373 30.6361 176.5792 10 H 3.9186 7.3379 114.8314 56.8183 25.8944 173.8083 11 Y 4.3554 7.3912 117.7077 58.0326 39.3033 176.5040 12 S 4.6300 8.5818 117.0693 58.3668 65.3656 175.1534 13 C 4.6294 8.3536 119.9689 57.5873 44.0238 173.3848 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 E 8.34 4.41 0.00 1.94 2.05 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 2.43 2.35 0.00 2 C 8.33 4.16 0.00 3.07 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 C 8.46 4.57 0.00 3.10 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 N 7.13 5.04 0.00 2.65 2.76 0.00 0.00 5.19 7.03 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 5 P 0.00 4.24 0.00 2.18 2.16 0.00 3.83 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 6 A 7.95 4.70 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.96 4.48 0.00 3.10 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 G 7.66 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 0.00 0.00 0.00 9 R 6.95 4.16 0.00 0.95 1.67 0.00 3.46 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 10 H 7.34 3.92 0.00 3.19 3.26 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 7.39 4.36 0.00 3.01 2.99 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 12 S 8.58 4.63 0.00 3.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.35 4.63 0.00 2.95 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