NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7872 8.2676 118.1367 53.4566 41.0776 175.9505 2 L 3.8181 8.1962 118.8214 58.7970 39.9082 177.4574 3 Y 3.9613 8.9583 121.9284 59.8011 39.0931 178.9819 4 I 3.8287 7.9287 120.6405 64.5055 35.7766 178.0078 5 Q 3.9616 8.3360 120.3322 58.6688 28.7088 178.1266 6 W 4.2100 8.2627 129.7558 60.2534 30.6711 178.1031 7 L 3.5918 8.3177 119.5822 57.4993 40.8844 179.6162 8 K 3.9032 8.0612 117.1191 59.7096 32.4924 177.6039 9 D 4.3065 7.1582 116.7837 54.7763 41.0984 176.9004 10 G 3.9408 8.5844 108.6100 44.2325 0.0000 175.2449 11 G 2.0000 6.4442 109.9036 44.8444 0.0000 175.1136 12 P 4.4664 0.0000 0.0000 65.3560 31.1392 177.2826 13 S 4.5637 7.7122 112.6578 58.7865 62.3044 174.2905 14 S 4.4689 7.4489 112.8209 57.4110 62.6325 174.1126 15 G 4.0062 8.5762 105.0542 45.9726 0.0000 173.8956 16 R 4.6925 7.8567 114.7277 53.2853 32.2503 173.1460 17 P 4.5976 0.0000 0.0000 61.4592 32.2130 174.2228 18 P 2.9700 0.0000 0.0000 61.0089 31.7097 174.2313 19 P 4.2633 0.0000 0.0000 62.4401 32.0034 176.4462 20 S 4.2715 8.5187 118.1622 58.7163 62.8198 173.9791 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 N 8.27 4.79 0.00 2.80 2.96 0.00 0.00 6.73 5.87 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 2 L 8.20 3.82 0.00 2.03 2.00 1.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 8.96 3.96 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 4 I 7.93 3.83 2.05 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.85 0.96 0.00 0.00 5 Q 8.34 3.96 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 6 W 8.26 4.21 0.00 3.26 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 7 L 8.32 3.59 0.00 1.91 1.69 1.24 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.06 3.90 0.00 1.80 2.01 0.00 1.45 0.00 0.00 1.68 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.62 7.81 9 D 7.16 4.31 0.00 2.67 2.59 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 G 8.58 3.94 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 11 G 6.44 2.00 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 12 P 0.00 4.47 0.00 2.21 2.23 0.00 3.42 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 13 S 7.71 4.56 0.00 3.92 3.81 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 14 S 7.45 4.47 0.00 3.55 3.61 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 G 8.58 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.86 4.69 0.00 2.02 1.94 0.00 3.03 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 17 P 0.00 4.60 0.00 2.13 2.10 0.00 3.83 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 18 P 0.00 2.97 0.00 1.61 0.49 0.00 3.61 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 19 P 0.00 4.26 0.00 2.15 1.99 0.00 2.59 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.84 0.00 20 S 8.52 4.27 0.00 3.85 3.78 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