NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3131 8.2644 123.5820 52.1017 19.8483 175.7215 2 V 4.3077 7.9565 121.3106 58.6524 34.9163 172.6392 3 Q 4.2942 9.2997 122.9999 56.5295 29.7714 175.4262 4 Q 4.5986 8.3831 113.9117 55.6347 31.0362 175.9038 5 N 4.8096 7.8771 114.1653 51.0352 42.4876 173.1395 6 K 3.8386 8.8124 124.0927 55.9561 31.9449 174.2235 7 P 4.1562 0.0000 0.0000 63.0564 31.8385 177.0564 8 T 3.9207 8.6170 117.4692 62.3447 69.1303 174.2153 9 R 3.9091 8.6859 123.7239 59.7344 29.1621 178.6630 10 S 4.0167 8.0890 113.0873 61.0941 62.1214 175.6185 11 K 3.7777 8.0756 120.1571 59.8472 32.0626 177.5904 12 R 4.0700 7.8487 118.0998 59.7705 29.8979 178.2685 13 G 3.7103 8.0382 104.6520 48.3990 0.0000 175.1664 14 M 4.2602 7.8508 119.8825 57.9455 31.9735 178.3062 15 R 4.1361 7.7791 117.5080 58.1460 30.5021 177.5370 16 R 4.3287 8.2965 116.8187 56.5914 30.1214 177.8260 17 S 4.0108 8.3126 111.9368 62.8330 62.6195 174.7323 18 H 4.3364 8.2162 120.9963 57.9366 29.3969 177.3899 19 D 4.6570 7.5184 115.5404 54.6026 39.7924 176.2419 20 A 4.4037 7.9249 123.8577 51.3110 20.0020 177.1845 21 L 4.6659 8.0151 119.1646 53.6249 43.9082 175.9407 22 T 4.7406 7.8699 112.4175 60.1323 71.3330 175.3943 23 A 4.6791 8.1224 132.9942 51.8635 17.8740 179.5737 24 V 4.3951 8.3022 109.7079 62.8327 34.4935 174.8339 25 T 3.4147 8.8689 107.9608 62.1164 67.5258 170.4463 26 S 3.8194 7.4593 120.1058 58.6415 63.7698 172.4371 27 L 4.8903 8.1026 122.1203 55.8089 43.3048 173.8114 28 S 4.9840 8.5229 112.4678 56.5382 66.8943 173.6072 29 V 4.7309 8.1039 119.2771 58.7422 33.1922 174.9936 30 D 4.4157 8.7710 125.1625 54.4167 42.0668 176.7108 31 K 4.1742 8.6110 122.0573 59.5786 32.7102 179.7508 32 T 4.0954 7.8839 115.0623 66.2162 68.6162 174.1769 33 S 4.4601 7.3518 113.0808 56.8024 65.8029 174.5528 34 G 3.6800 8.6102 114.7903 45.4821 0.0000 172.5655 35 E 4.4744 8.1824 122.4703 54.1741 32.1456 174.0812 36 K 4.2675 8.7453 124.2762 57.3014 32.3732 175.1644 37 H 5.1073 8.9514 123.1114 53.1121 32.0812 172.7802 38 L 4.1459 8.4046 122.7247 54.7992 43.1984 176.4558 39 R 3.8645 8.5457 124.8853 58.5024 30.4214 176.6069 40 H 4.5245 10.3278 117.8016 56.1919 26.4735 174.2753 41 H 3.8213 8.3539 112.7170 55.2284 31.1953 174.6443 42 I 3.3107 7.0115 120.2933 60.4077 35.9079 175.5576 43 T 4.3633 9.1491 117.1120 61.1350 70.3555 174.8740 44 A 4.2906 7.6064 122.1628 52.8081 17.9379 177.5441 45 D 4.4855 7.9748 124.6087 54.7929 45.7215 177.3294 46 G 4.4253 7.6932 105.2319 45.3375 0.0000 172.3955 47 Y 4.8267 8.8574 119.3833 57.3679 40.6079 175.1586 48 Y 5.2479 8.8312 124.5488 58.4677 44.3457 175.1149 49 R 4.2495 9.9034 113.7722 54.5568 31.4956 177.6088 50 G 4.1401 8.9747 106.0195 47.2271 0.0000 171.9046 51 R 3.6208 8.1552 116.9267 57.2983 31.3637 177.5814 52 K 4.1366 7.6385 109.6816 55.9365 33.7782 175.1298 53 V 3.6863 8.4250 116.9093 61.5722 32.5459 173.1041 54 I 3.6806 8.4221 129.5933 61.1746 37.0831 174.1510 55 A 4.1570 8.5808 129.1761 53.8277 20.2231 177.3163 56 K 4.5964 8.3695 114.0392 57.6152 34.3530 174.3112 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 A 8.26 4.31 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 2 V 7.96 4.31 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 0.86 0.00 0.00 0.93 0.00 0.00 3 Q 9.30 4.29 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.62 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 4 Q 8.38 4.60 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 5 N 7.88 4.81 0.00 2.63 2.66 0.00 0.00 6.85 7.61 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 6 K 8.81 3.84 0.00 1.71 1.79 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.48 7.81 7 P 0.00 4.16 0.00 2.07 2.02 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 8 T 8.62 3.92 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 1.22 0.00 0.00 9 R 8.69 3.91 0.00 2.07 2.20 0.00 3.03 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 10 S 8.09 4.02 0.00 3.90 3.91 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 K 8.08 3.78 0.00 1.76 2.06 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.58 7.81 12 R 7.85 4.07 0.00 1.93 2.18 0.00 3.16 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 13 G 8.04 3.71 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 14 M 7.85 4.26 0.00 1.99 2.30 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 2.84 2.56 0.00 15 R 7.78 4.14 0.00 1.79 2.12 0.00 3.24 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 16 R 8.30 4.33 0.00 1.96 1.92 0.00 3.20 0.00 0.00 3.21 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 17 S 8.31 4.01 0.00 4.04 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 18 H 8.22 4.34 0.00 3.20 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.52 4.66 0.00 2.76 2.68 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 A 7.92 4.40 1.31 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 21 L 8.02 4.67 0.00 1.63 1.61 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.87 4.74 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 23 A 8.12 4.68 1.12 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 24 V 8.30 4.40 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 0.83 0.00 0.00 0.96 0.00 0.00 25 T 8.87 3.41 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 26 S 7.46 3.82 0.00 4.16 3.91 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 27 L 8.10 4.89 0.00 1.77 1.54 1.01 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.52 4.98 0.00 3.90 3.91 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 29 V 8.10 4.73 2.10 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 0.97 0.00 0.00 0.96 0.00 0.00 30 D 8.77 4.42 0.00 2.53 2.75 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 31 K 8.61 4.17 0.00 1.85 1.81 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.43 7.81 32 T 7.88 4.10 4.54 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 1.41 0.00 0.00 33 S 7.35 4.46 0.00 3.62 3.18 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 34 G 8.61 3.68 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 35 E 8.18 4.47 0.00 2.07 1.93 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 2.23 2.17 0.00 36 K 8.75 4.27 0.00 1.77 1.83 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.52 7.81 37 H 8.95 5.11 0.00 3.28 3.48 0.00 5.32 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.40 4.15 0.00 1.76 1.71 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.55 3.86 0.00 1.85 2.01 0.00 3.61 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 40 H 10.33 4.52 0.00 3.20 3.53 0.00 5.94 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 41 H 8.35 3.82 0.00 2.96 3.01 0.00 5.58 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.01 3.31 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 0.92 0.00 0.00 43 T 9.15 4.36 4.44 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 1.32 0.00 0.00 44 A 7.61 4.29 1.32 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 45 D 7.97 4.49 0.00 2.86 2.75 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 46 G 7.69 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 8.86 4.83 0.00 3.03 3.20 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 0.00 48 Y 8.83 5.25 0.00 2.85 2.62 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 49 R 9.90 4.25 0.00 1.29 1.60 0.00 3.02 0.00 0.00 2.78 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.50 0.00 50 G 8.97 4.14 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 51 R 8.16 3.62 0.00 1.92 2.01 0.00 3.21 0.00 0.00 3.12 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 52 K 7.64 4.14 0.00 0.79 1.33 0.00 1.54 0.00 0.00 1.55 0.00 0.00 3.19 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.03 0.54 7.81 53 V 8.43 3.69 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 0.85 0.00 0.00 1.04 0.00 0.00 54 I 8.42 3.68 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 1.34 0.33 0.91 0.00 0.00 55 A 8.58 4.16 1.25 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 56 K 8.37 4.60 0.00 1.97 2.16 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.44 7.81