NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0725 8.0393 114.0558 61.3174 32.9707 174.8657 2 M 4.1157 8.2170 119.4673 53.4367 32.3591 174.4855 3 A 3.9695 8.3267 122.9003 52.4020 19.5260 177.2496 4 P 4.5552 0.0000 0.0000 63.4567 32.0329 176.0266 5 R 4.7213 7.3905 117.8541 55.5601 33.5541 174.1257 6 T 4.3940 8.0178 116.9505 61.1131 69.1761 172.2323 7 L 4.7511 8.2926 118.7404 52.9945 44.6387 176.2088 8 F 4.2571 8.8074 121.8847 56.2720 38.5338 175.8414 9 L 4.2187 8.4116 124.8883 54.9806 41.4235 177.4185 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 V 8.04 4.07 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 0.91 0.00 0.00 0.93 0.00 0.00 2 M 8.22 4.12 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.59 0.00 3 A 8.33 3.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.56 0.00 2.19 2.17 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 5 R 7.39 4.72 0.00 1.75 1.78 0.00 3.22 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 6 T 8.02 4.39 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 7 L 8.29 4.75 0.00 1.62 1.55 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.81 4.26 0.00 3.02 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 9 L 8.41 4.22 0.00 1.65 1.60 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00