NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9796 8.2127 109.7430 45.2523 0.0000 173.8756 2 I 3.1083 7.8838 117.6083 63.0100 37.5765 172.9585 3 V 3.5120 8.3450 120.0284 65.8518 31.6600 177.2210 4 E 3.9293 7.9956 116.7026 59.6248 29.4967 178.7475 5 Q 4.1634 8.1978 118.2717 58.4162 29.2896 176.3448 6 C 5.1985 8.3304 115.4540 55.8039 41.6145 174.0805 7 C 4.7387 7.9017 117.3034 59.5202 28.3517 174.1010 8 T 4.4334 7.9674 115.4380 62.3883 68.9829 173.7578 9 S 4.7900 7.5321 113.4454 55.7134 66.3281 172.9370 10 I 3.8806 8.1922 122.1122 61.5948 37.2148 176.9263 11 C 4.7781 8.6112 123.3824 56.2371 42.2940 174.3417 12 S 4.5161 8.8952 118.9738 57.9902 64.8077 175.6066 13 L 4.0411 8.4282 122.0018 58.0021 41.0903 179.1636 14 Y 4.2995 7.8822 119.6476 60.2801 38.9968 177.5450 15 Q 4.0793 8.2505 118.9672 59.0646 28.7878 178.8694 16 L 4.2003 8.1262 119.8733 57.9925 41.5183 179.4386 17 E 3.9018 8.0727 118.3210 59.0835 29.0570 178.6645 18 N 4.0807 7.3178 116.4905 56.0459 38.8548 175.2796 19 Y 4.5154 7.4007 115.5175 57.1661 38.7268 175.6430 20 C 4.4086 7.1902 118.1221 59.3608 28.9942 173.5131 21 N 4.5263 8.5527 117.9057 53.7910 38.1310 175.3171 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 8.21 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 7.88 3.11 0.56 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.03 0.61 0.00 0.00 3 V 8.34 3.51 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 0.98 0.00 0.00 0.86 0.00 0.00 4 E 8.00 3.93 0.00 2.13 2.01 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 2.32 2.43 0.00 5 Q 8.20 4.16 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 6 C 8.33 5.20 0.00 2.99 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 7 C 7.90 4.74 0.00 3.22 2.89 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 7.97 4.43 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 1.21 0.00 0.00 9 S 7.53 4.79 0.00 3.99 3.90 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 10 I 8.19 3.88 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.54 0.93 0.00 0.00 11 C 8.61 4.78 0.00 3.00 3.07 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 8.90 4.52 0.00 4.13 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 13 L 8.43 4.04 0.00 1.77 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.88 4.30 0.00 2.93 3.02 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 8.25 4.08 0.00 2.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 16 L 8.13 4.20 0.00 1.93 1.78 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.07 3.90 0.00 1.93 1.82 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 2.30 2.49 0.00 18 N 7.32 4.08 0.00 2.28 2.10 0.00 0.00 7.14 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.40 4.52 0.00 3.10 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 20 C 7.19 4.41 0.00 3.01 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.55 4.53 0.00 2.71 2.73 0.00 0.00 6.80 7.56 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