NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2844 8.3049 120.3487 55.3775 33.4210 176.5705 2 L 4.2565 7.5216 119.4876 52.9952 41.9943 174.7226 3 S 4.6978 8.5511 116.9608 56.6562 66.2422 177.9654 4 V 3.6449 8.0665 121.5004 64.5176 31.2636 178.4860 5 A 4.0390 7.9012 118.7405 54.7958 18.4306 179.0672 6 A 4.0744 7.5875 118.4485 54.9237 18.5128 179.5060 7 R 4.0854 7.8139 116.5928 56.5557 30.4661 172.8416 8 S 3.7230 7.6061 118.0565 59.2502 60.0628 170.9580 9 G 4.7249 7.4297 123.5223 46.2451 0.0000 169.7387 10 P 4.8110 0.0000 0.0000 61.6986 32.6351 175.4450 11 F 4.6718 8.6397 117.2430 56.1009 40.5052 175.3873 12 A 4.8494 8.1855 124.3930 49.4580 21.7852 172.7538 13 P 5.3184 0.0000 0.0000 60.9908 34.0401 174.6960 14 V 4.4069 8.3307 122.0500 61.0851 33.9676 174.1213 15 L 5.1501 8.5776 129.2830 53.5704 44.4779 174.9755 16 S 4.6487 8.3139 116.0563 56.2942 66.1817 173.8454 17 A 4.0746 8.6724 123.5541 55.2334 18.0350 178.8404 18 T 4.4780 7.7315 102.3009 61.4131 70.1569 174.4820 19 S 4.7942 7.2900 117.4765 56.2427 66.2996 174.1596 20 R 4.0427 8.5076 122.1378 56.0083 30.4643 176.9974 21 G 3.8313 8.5708 108.5257 46.9170 0.0000 172.7327 22 V 4.7089 8.4564 122.2217 60.7249 34.8686 174.0825 23 A 4.8752 8.2126 126.1638 51.1380 21.9766 177.0278 24 G 2.2675 9.0140 109.3209 44.3730 0.0000 173.5872 25 A 4.6770 7.8680 120.8152 52.4080 18.4330 177.4244 26 L 4.8704 5.6200 117.3818 54.4099 42.9896 176.8034 27 R 3.9003 8.2654 113.6127 55.5602 30.0233 174.0186 28 P 4.5214 0.0000 0.0000 62.8826 32.1479 176.3686 29 L 4.3693 8.0508 121.4999 54.7734 42.7700 175.1646 30 V 4.1600 8.1886 118.7561 63.2152 32.9678 175.8149 31 Q 4.5035 8.0518 115.3152 55.7860 28.6877 175.7233 32 A 4.5191 7.9028 121.9742 53.2988 21.0727 177.7830 33 A 4.4284 7.9554 115.3660 52.0281 18.9609 177.8173 34 V 3.9884 7.6438 116.2908 63.8182 32.5203 174.4363 35 P 4.5790 0.0000 0.0000 61.3762 32.3374 175.2456 36 A 4.7124 8.2938 127.6761 52.6288 21.3836 175.6071 37 T 3.4152 8.3603 107.0283 64.9212 65.9662 174.0157 38 S 4.5354 7.6603 116.8187 56.5705 62.3752 174.1835 39 E 3.7257 8.7505 126.8548 58.4582 29.6522 178.5402 40 S 3.3071 8.1349 108.0949 58.2677 61.7357 170.1570 41 P 4.4340 0.0000 0.0000 62.9222 29.8732 176.4353 42 V 4.3039 7.8360 125.0806 58.8114 30.7885 175.8762 43 L 5.2103 7.3129 126.5393 54.9884 44.7279 170.6748 44 D 4.4365 8.1655 120.3145 53.5507 44.0217 177.4533 45 L 3.5640 8.0940 121.0517 56.5036 38.3624 173.9963 46 K 4.5557 7.4076 128.0604 55.4180 35.5852 176.0113 47 R 4.2721 8.2499 120.5251 55.6996 30.8814 175.3793 48 S 4.5408 8.2328 113.7253 57.4679 64.0875 174.7820 49 V 3.7167 8.0096 124.1452 63.8039 32.0186 176.4306 50 L 3.8622 8.5764 125.4035 53.9229 41.8568 172.3934 51 C 3.9058 7.7161 119.1046 59.1491 28.2155 173.3892 52 R 4.4609 8.1324 121.1238 55.1893 30.4913 174.0220 53 E 4.7002 8.2388 123.7938 53.8827 30.7269 176.5701 54 S 4.6474 7.7805 121.6153 56.5671 63.3545 175.0221 55 L 4.5241 7.5723 119.1331 54.3415 43.4688 177.3969 56 R 4.3548 8.1801 120.7686 54.7147 31.6489 177.0984 57 G 3.7715 8.4597 106.7124 46.2262 0.0000 173.5310 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 M 8.30 4.28 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 L 7.52 4.26 0.00 1.72 1.63 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.55 4.70 0.00 3.81 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.07 3.64 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 1.02 0.00 0.00 0.94 0.00 0.00 5 A 7.90 4.04 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 6 A 7.59 4.07 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 4.09 0.00 2.09 2.06 0.00 3.41 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 8 S 7.61 3.72 0.00 4.01 3.93 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 0.00 0.00 0.00 9 G 7.43 4.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.81 0.00 2.25 2.13 0.00 3.86 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 2.02 2.01 0.00 11 F 8.64 4.67 0.00 2.89 3.10 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 0.00 0.00 0.00 0.00 12 A 8.19 4.85 1.14 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 13 P 0.00 5.32 0.00 2.09 2.08 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 14 V 8.33 4.41 2.06 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 0.92 0.00 0.00 0.90 0.00 0.00 15 L 8.58 5.15 0.00 1.68 1.51 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.31 4.65 0.00 3.95 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.67 4.07 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.73 4.48 4.31 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 1.21 0.00 0.00 19 S 7.29 4.79 0.00 3.78 3.75 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 20 R 8.51 4.04 0.00 1.79 1.87 0.00 3.38 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 21 G 8.57 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.46 4.71 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 0.89 0.00 0.00 0.91 0.00 0.00 23 A 8.21 4.88 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 24 G 9.01 2.27 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 0.00 25 A 7.87 4.68 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 5.62 4.87 0.00 1.65 1.75 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 27 R 8.27 3.90 0.00 1.98 2.08 0.00 3.30 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 28 P 0.00 4.52 0.00 2.21 2.10 0.00 3.83 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 29 L 8.05 4.37 0.00 1.57 1.62 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.19 4.16 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 31 Q 8.05 4.50 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 32 A 7.90 4.52 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.96 4.43 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.64 3.99 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 0.96 0.00 0.00 35 P 0.00 4.58 0.00 2.08 1.97 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 36 A 8.29 4.71 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 37 T 8.36 3.42 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 38 S 7.66 4.54 0.00 4.00 4.04 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 39 E 8.75 3.73 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 40 S 8.13 3.31 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.43 0.00 2.07 2.09 0.00 3.63 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 2.03 2.07 0.00 42 V 7.84 4.30 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 0.80 0.00 0.00 0.98 0.00 0.00 43 L 7.31 5.21 0.00 1.68 1.57 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.17 4.44 0.00 2.62 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.09 3.56 0.00 1.83 2.07 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.41 4.56 0.00 1.84 1.72 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.43 7.81 47 R 8.25 4.27 0.00 1.96 1.97 0.00 3.08 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 48 S 8.23 4.54 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.01 3.72 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 0.96 0.00 0.00 0.93 0.00 0.00 50 L 8.58 3.86 0.00 1.81 1.85 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.72 3.91 0.00 3.16 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.13 4.46 0.00 1.68 1.78 0.00 3.22 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 53 E 8.24 4.70 0.00 1.92 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 54 S 7.78 4.65 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.57 4.52 0.00 1.65 1.62 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.18 4.35 0.00 1.79 1.88 0.00 3.21 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 57 G 8.46 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00