NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5625 8.1933 115.5523 58.4643 64.8144 173.4492 2 C 4.9902 8.5412 118.9398 53.2570 43.9234 172.5371 3 T 4.2602 9.2260 114.1134 61.9769 70.1077 174.1560 4 R 4.5299 8.2118 119.7474 56.1388 30.4557 176.3236 5 S 4.6119 7.7809 111.9080 56.7972 65.5105 173.1664 6 I 4.3336 7.9637 120.7696 58.8470 38.0941 174.1123 7 P 4.6242 0.0000 0.0000 60.9544 32.4921 174.1730 8 P 4.5746 0.0000 0.0000 63.0034 32.5353 175.5212 9 Q 4.6126 8.8502 120.0933 54.4643 31.2982 175.2706 10 C 5.0949 8.6597 120.5292 56.1012 41.5507 174.1310 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 S 8.19 4.56 0.00 3.92 4.06 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 2 C 8.54 4.99 0.00 3.00 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 3 T 9.23 4.26 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 1.26 0.00 0.00 4 R 8.21 4.53 0.00 1.81 1.97 0.00 3.18 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 5 S 7.78 4.61 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.96 4.33 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 1.47 0.68 0.91 0.00 0.00 7 P 0.00 4.62 0.00 2.17 2.04 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 8 P 0.00 4.57 0.00 2.10 2.09 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 9 Q 8.85 4.61 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 10 C 8.66 5.09 0.00 2.81 3.03 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 0.00 0.00 0.00 0.00